elements listlengths 1 9 | nsites int32 1 444 | chemical_formula_anonymous stringlengths 1 18 | chemical_formula_reduced stringlengths 1 23 | chemical_formula_descriptive stringlengths 2 34 | nelements int8 1 9 | dimension_types listlengths 3 3 | nperiodic_dimensions int8 3 3 | lattice_vectors listlengths 3 3 | immutable_id stringlengths 4 13 ⌀ | cartesian_site_positions listlengths 1 444 | species stringlengths 138 1.25k | species_at_sites listlengths 1 444 | last_modified stringlengths 19 19 | elements_ratios listlengths 1 9 | stress_tensor listlengths 0 3 | energy float64 -2,749.01 5.19k | magnetic_moments listlengths 0 444 | forces listlengths 0 444 | total_magnetization float64 -340.3 383 ⌀ | dos_ef float64 -14.23 392 ⌀ | functional stringclasses 1 value | cross_compatibility bool 1 class | entalpic_fingerprint stringlengths 37 62 ⌀ |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
[
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"Pr"
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1,
1,
1
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"Pr",
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"Er",
"Er"
] | 2023-11-16 06:57:59 | [
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] | 0 | 18.565216 | pbe | true | e42aa341013f6a27079fb072d93435f2_10_La7Pr3Er2 |
[
"Er",
"La",
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] | 8 | A6BC | ErLa6Sc | La6 Er1 Sc1 | 3 | [
1,
1,
1
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"La",
"La",
"La",
"La",
"La",
"Er",
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] | -0.000045 | 9.029086 | pbe | true | 4ec65847998a7cbfa91ec3f0c76edc4d_123_La6Er1Sc1 |
[
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"Sm",
"Sm",
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"Er",
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] | 2023-11-16 06:57:59 | [
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] | 0.000008 | 28.382685 | pbe | true | 2bb0fd66d8c0138248b26e44c75b938a_123_La1Sm15Er4 |
[
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] | 26 | A6B5C2 | Er6La2Sm5 | La4 Sm10 Er12 | 3 | [
1,
1,
1
] | 3 | [
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] | [{"mass": null, "name": "La", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["La"]}, {"mass": null, "name": "Er", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Er"]}, {"mass": null, "name": "Sm", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Sm"]}] | [
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"Er",
"Er",
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] | 2023-11-16 06:57:59 | [
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] | -0.000009 | 36.165813 | pbe | true | 0958de6f8227a52152e4b5fc0470d598_55_La4Sm10Er12 |
[
"Er",
"La",
"Tb"
] | 12 | A9B2C | ErLa2Tb9 | La2 Tb9 Er1 | 3 | [
1,
1,
1
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] | 2023-11-16 06:57:59 | [
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] | -0.000302 | 19.278599 | pbe | true | 8c9dfc7d85756ec9ccb0dbf8f994d1ef_123_La2Tb9Er1 |
[
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1,
1,
1
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]
] | -0.025725 | 7.640698 | pbe | true | 8ea3d37e5978b2ff263c4c2f9af419af_123_La3Er1Zn2 |
[
"Er",
"Li",
"Ni"
] | 4 | A2BC | Er2LiNi | Li1 Er2 Ni1 | 3 | [
1,
1,
1
] | 3 | [
[
4.8751665,
0,
0
],
[
2.43758325,
4.22201803,
0
],
[
2.43758325,
1.40733934,
3.98055678
]
] | agm002284095 | [
[
7.312749749999999,
4.2220180275,
2.985417585
],
[
2.43758325,
1.4073393425,
0.995139195
],
[
0,
0,
0
],
[
4.8751665,
2.814678685,
1.99027839
]
] | [{"mass": null, "name": "Li", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Li"]}, {"mass": null, "name": "Ni", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Ni"]}, {"mass": null, "name": "Er", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Er"]}] | [
"Ni",
"Li",
"Er",
"Er"
] | 2023-11-16 06:57:59 | [
0.5,
0.25,
0.25
] | [
[
-3.599691,
0,
0
],
[
0,
-3.599691,
0
],
[
0,
0,
-3.599691
]
] | -17.489227 | [
0,
0,
0,
0
] | [
[
0,
0,
0
],
[
0,
0,
0
],
[
0,
0,
0
],
[
0,
0,
0
]
] | -0.000046 | 4.902712 | pbe | true | 65820c8d651554fe3553580822104907_225_Li1Er2Ni1 |
[
"Er",
"Li",
"Zn"
] | 7 | A4B2C | ErLi2Zn4 | Li2 Er1 Zn4 | 3 | [
1,
1,
1
] | 3 | [
[
4.25666706,
0,
2.45737499
],
[
2.12833403,
4.87746748,
1.228688
],
[
-0.31024171,
0,
5.45278936
]
] | agm005970509 | [
[
4.101546455,
2.43873374,
5.1837699225
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[
1.9732129250000001,
2.43873374,
3.9550824275
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[
0,
0,
0
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[
2.7550939207094887,
0,
5.058401111347378
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[
3.3196654592905115,
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4.080451238652621
],
[
1.8180920121208102,
1.8741260060125176,
6.681477049042018
],
[
4.25666736787919,
3.0033414739874824,
2.457375300957982
]
] | [{"mass": null, "name": "Li", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Li"]}, {"mass": null, "name": "Er", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Er"]}, {"mass": null, "name": "Zn", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Zn"]}] | [
"Li",
"Li",
"Er",
"Zn",
"Zn",
"Zn",
"Zn"
] | 2023-11-16 06:57:59 | [
0.14285714285714285,
0.2857142857142857,
0.5714285714285714
] | [
[
2.3636963,
2.5e-7,
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[
2.5e-7,
2.4055586,
2.5e-7
],
[
-0.02416703,
2.5e-7,
2.3916066
]
] | -15.470792 | [
0,
0,
0,
0,
0,
0,
0
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[
0,
0,
0
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[
0,
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[
0,
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[
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[
0.00020155,
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[
0,
-0.00040313,
0
],
[
0,
0.00040313,
0
]
] | 0.000005 | 2.431497 | pbe | true | 74d5fbdc62c344d04a078f0cc10d498b_139_Li2Er1Zn4 |
[
"Er",
"Lu",
"Pb"
] | 4 | A2BC | Er2LuPb | Er2 Lu1 Pb1 | 3 | [
1,
1,
1
] | 3 | [
[
3.60016805,
0,
0
],
[
0,
3.60016805,
0
],
[
0,
0,
9.0309574
]
] | agm001157458 | [
[
1.800084025,
1.800084025,
0
],
[
1.800084025,
1.800084025,
4.5154787
],
[
0,
0,
6.867389532312962
],
[
0,
0,
2.1635678676870382
]
] | [{"mass": null, "name": "Pb", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Pb"]}, {"mass": null, "name": "Er", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Er"]}, {"mass": null, "name": "Lu", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Lu"]}] | [
"Pb",
"Lu",
"Er",
"Er"
] | 2023-11-16 06:57:59 | [
0.5,
0.25,
0.25
] | [
[
1.4927443,
0,
0
],
[
0,
1.4927443,
0
],
[
0,
0,
1.9024173
]
] | -18.162901 | [
0,
0,
0,
0
] | [
[
0,
0,
0
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[
0,
0,
0
],
[
0,
0,
-0.00116374
],
[
0,
0,
0.00116374
]
] | -0.000273 | 3.540688 | pbe | true | eb05e9530ba44182372e1b8825cefddc_123_Er2Lu1Pb1 |
[
"Er",
"Mg",
"Pb"
] | 12 | A3B2C | ErMg2Pb3 | Er2 Mg4 Pb6 | 3 | [
1,
1,
1
] | 3 | [
[
4.73581532,
0,
0
],
[
0,
6.94965437,
0
],
[
0,
0,
9.82530371
]
] | agm003427736 | [
[
0,
6.319431496131658,
9.287476803230458
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[
0,
2.8446043111316577,
0.5378269067695416
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[
0,
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[
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[
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1.6483197734687283
],
[
0,
6.299582101809695,
5.922346341420074
]
] | [{"mass": null, "name": "Pb", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Pb"]}, {"mass": null, "name": "Er", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Er"]}, {"mass": null, "name": "Mg", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Mg"]}] | [
"Er",
"Er",
"Mg",
"Mg",
"Mg",
"Mg",
"Pb",
"Pb",
"Pb",
"Pb",
"Pb",
"Pb"
] | 2023-11-16 06:57:59 | [
0.16666666666666666,
0.3333333333333333,
0.5
] | [
[
3.5234609,
0,
0
],
[
0,
3.6251597,
0
],
[
0,
0,
3.8275106
]
] | -39.813388 | [
0,
0,
0,
0,
0,
0,
0,
0,
0,
0,
0,
0
] | [
[
0,
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[
0,
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[
0,
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[
0,
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[
0,
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0,
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[
0,
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[
0,
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[
0,
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[
0,
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[
0,
-0.00018958,
0.00015534
],
[
0,
0.00658471,
-0.00352727
]
] | 0.000001 | 3.88935 | pbe | true | 929a440955d6b81799110e2916739655_26_Er2Mg4Pb6 |
[
"Er",
"Mg",
"Pd"
] | 11 | A8B2C | ErMg2Pd8 | Er1 Mg2 Pd8 | 3 | [
1,
1,
1
] | 3 | [
[
4.11276446,
0,
0
],
[
0,
6.36797988,
0.31459102
],
[
-2.05638223,
-2.36920541,
6.77579826
]
] | agm003532780 | [
[
2.05638223,
0,
0
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[
2.05638428638223,
0.8924053828437583,
3.8589434118122625
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[
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[
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5.6403501933278735
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[
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[
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[
0.0000020563822300421357,
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1.4500390866721262
],
[
2.0563822286887175e-8,
4.394233590055102,
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]
] | [{"mass": null, "name": "Er", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Er"]}, {"mass": null, "name": "Mg", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Mg"]}, {"mass": null, "name": "Pd", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Pd"]}] | [
"Er",
"Mg",
"Mg",
"Pd",
"Pd",
"Pd",
"Pd",
"Pd",
"Pd",
"Pd",
"Pd"
] | 2023-11-16 06:57:59 | [
0.09090909090909091,
0.18181818181818182,
0.7272727272727273
] | [
[
6.372019,
0,
0
],
[
0,
6.686566,
0.04137147
],
[
0,
0.04137156,
6.477438
]
] | -56.147197 | [
0,
0,
0,
0,
0,
0,
0,
0,
0,
0,
0
] | [
[
0,
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[
0,
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[
0,
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[
0,
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[
0,
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[
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[
0,
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[
0,
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[
0,
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],
[
0,
0.00308988,
-0.00094413
],
[
0,
0.00002412,
0.00132869
]
] | -0.000001 | 3.825279 | pbe | true | ea0fe0b3b1792d992eccc26874cec168_12_Er1Mg2Pd8 |
[
"Er",
"Nd",
"Sm"
] | 10 | A2B2C | ErNd2Sm2 | Nd4 Sm4 Er2 | 3 | [
1,
1,
1
] | 3 | [
[
5.8025708,
0,
0
],
[
0,
3.63504355,
0
],
[
-2.9012854,
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16.16505362
]
] | agm003387046 | [
[
2.9012824987145995,
0.9087627054576652,
1.4092380143875771
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[
2.901285429012854,
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[
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[
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[
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[
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[
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[
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] | [{"mass": null, "name": "Nd", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Nd"]}, {"mass": null, "name": "Sm", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Sm"]}, {"mass": null, "name": "Er", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Er"]}] | [
"Nd",
"Nd",
"Nd",
"Nd",
"Sm",
"Sm",
"Sm",
"Sm",
"Er",
"Er"
] | 2023-11-16 06:57:59 | [
0.2,
0.4,
0.4
] | [
[
1.2485242,
0,
0
],
[
0,
1.3198303,
0
],
[
0,
0,
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]
] | -45.707626 | [
0,
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0,
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0,
0
] | [
[
0,
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[
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[
0,
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[
0,
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[
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[
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[
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[
0,
0,
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[
0,
0,
0.00152814
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[
0,
0,
-0.00152814
]
] | 0.000008 | 14.903322 | pbe | true | df537249e0ab483ad3d0e0a36eeb7338_74_Nd4Sm4Er2 |
[
"Er",
"Mg",
"Pm"
] | 12 | A9B2C | Er2Mg9Pm | Pm1 Er2 Mg9 | 3 | [
1,
1,
1
] | 3 | [
[
5.78415694,
0.00000103,
1.72145281
],
[
2.63591393,
5.14863372,
1.72145281
],
[
0.07545943,
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10.32468763
]
] | agm005892486 | [
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0,
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0
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[
1.256627084083152,
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[
2.064999087608306,
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] | [{"mass": null, "name": "Mg", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Mg"]}, {"mass": null, "name": "Er", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Er"]}, {"mass": null, "name": "Pm", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Pm"]}] | [
"Pm",
"Er",
"Er",
"Mg",
"Mg",
"Mg",
"Mg",
"Mg",
"Mg",
"Mg",
"Mg",
"Mg"
] | 2023-11-16 06:57:59 | [
0.16666666666666666,
0.75,
0.08333333333333333
] | [
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[
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[
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]
] | -28.725315 | [
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],
[
0.00516837,
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]
] | 0.000509 | 10.77709 | pbe | true | 1f0436a387fb5baf1cc72c722ad3e8da_166_Pm1Er2Mg9 |
[
"Er",
"Mg",
"Pr"
] | 14 | A4B2C | Er2MgPr4 | Pr8 Er4 Mg2 | 3 | [
1,
1,
1
] | 3 | [
[
6.88743285,
0,
0
],
[
3.44371643,
8.23438031,
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],
[
3.44371643,
1.60703281,
8.15544529
]
] | agm003463654 | [
[
3.4437164284353514,
3.4635518323701997,
2.2957717255675365
],
[
6.887432858435351,
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],
[
6.887432852837266,
1.1354344976319104,
4.314489998559538
],
[
1.721858215,
4.117190155,
-0.567631765
],
[
5.16557464,
4.117190155,
-0.567631765
]
] | [{"mass": null, "name": "Pr", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Pr"]}, {"mass": null, "name": "Er", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Er"]}, {"mass": null, "name": "Mg", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Mg"]}] | [
"Pr",
"Pr",
"Pr",
"Pr",
"Pr",
"Pr",
"Pr",
"Pr",
"Er",
"Er",
"Er",
"Er",
"Mg",
"Mg"
] | 2023-11-16 06:57:59 | [
0.2857142857142857,
0.14285714285714285,
0.5714285714285714
] | [
[
0.402552,
0,
0
],
[
0,
0.29491398,
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],
[
0,
-0.00031793,
0.29513288
]
] | -57.069369 | [
0,
0,
0,
0,
0,
0,
0,
0,
0,
0,
0,
0,
0,
0
] | [
[
0,
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],
[
0,
0.00335084,
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],
[
0.00117635,
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[
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[
0,
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[
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[
0,
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[
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[
0,
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],
[
0,
0,
0
],
[
0,
0,
0
]
] | 0.001559 | 15.531346 | pbe | true | 97ead64cc1173f61733ff37383cd6222_74_Pr8Er4Mg2 |
[
"Er",
"Mg",
"Sc"
] | 5 | A2B2C | Er2Mg2Sc | Er2 Mg2 Sc1 | 3 | [
1,
1,
1
] | 3 | [
[
5.06084738,
0,
0
],
[
2.53042369,
5.27112063,
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],
[
2.53042369,
1.33140192,
5.10088263
]
] | agm003405037 | [
[
2.53042369,
2.008972050890396,
1.526747881837122
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[
7.59127107,
4.593550499109605,
3.4909363181628783
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[
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],
[
5.06084738,
4.158200050058243,
1.3812387353021591
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[
0,
0,
0
]
] | [{"mass": null, "name": "Sc", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Sc"]}, {"mass": null, "name": "Er", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Er"]}, {"mass": null, "name": "Mg", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Mg"]}] | [
"Er",
"Er",
"Mg",
"Mg",
"Sc"
] | 2023-11-16 06:57:59 | [
0.4,
0.4,
0.2
] | [
[
0.9199342,
0,
0
],
[
0,
0.9160823,
0.13998015
],
[
0,
0.13998015,
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]
] | -18.121952 | [
0,
0,
0,
0,
0
] | [
[
0,
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[
0,
0.00031582,
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[
0,
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],
[
0,
0.01239987,
-0.01631638
],
[
0,
0,
0
]
] | -0.000016 | 6.587603 | pbe | true | b8a4d4225af6f56afadaf732169a9ad6_71_Er2Mg2Sc1 |
[
"Er",
"Mg",
"Tm"
] | 10 | A2B2C | Er2MgTm2 | Er4 Tm4 Mg2 | 3 | [
1,
1,
1
] | 3 | [
[
5.39906877,
-0.00010255,
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],
[
-2.69971179,
4.67719695,
-0.00281347
],
[
0.00015895,
0.00777571,
11.70334189
]
] | agm003386912 | [
[
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1.5587777710891684,
2.884301929465987
],
[
0.00010899900079997745,
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2.6995076477868687,
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2.699463049136811,
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0.00004371286793481442,
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11.66604965009102
],
[
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5.811176532370329
]
] | [{"mass": null, "name": "Mg", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Mg"]}, {"mass": null, "name": "Er", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Er"]}, {"mass": null, "name": "Tm", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Tm"]}] | [
"Er",
"Er",
"Er",
"Er",
"Tm",
"Tm",
"Tm",
"Tm",
"Mg",
"Mg"
] | 2023-11-16 06:57:59 | [
0.4,
0.2,
0.4
] | [
[
0.46236393,
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0.00026213
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[
0.00661712,
0.44580564,
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],
[
0.0002622,
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0.22179525
]
] | -38.289156 | [
0,
0,
0,
0,
0,
0,
0,
0,
0,
0
] | [
[
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[
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[
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[
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0.00005007,
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[
-0.0000147,
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0.01347674
],
[
0.00000999,
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0.01610839
]
] | 0.000005 | 12.837277 | pbe | true | 0ad698027d92be8790b4968edc933b6a_186_Er4Tm4Mg2 |
[
"Er",
"Mn",
"Os"
] | 4 | A2BC | Er2MnOs | Er2 Mn1 Os1 | 3 | [
1,
1,
1
] | 3 | [
[
4.85995161,
0,
0
],
[
2.42997581,
4.20884156,
0
],
[
2.42997581,
1.40294719,
3.96813387
]
] | agm001094331 | [
[
4.859951615,
2.805894375,
1.984066935
],
[
0,
0,
0
],
[
2.4299758075,
1.4029471875,
0.9920334675
],
[
7.2899274225,
4.2088415625,
2.9761004025
]
] | [{"mass": null, "name": "Mn", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Mn"]}, {"mass": null, "name": "Os", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Os"]}, {"mass": null, "name": "Er", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Er"]}] | [
"Mn",
"Os",
"Er",
"Er"
] | 2023-11-16 06:57:59 | [
0.5,
0.25,
0.25
] | [
[
2.344931,
0,
0
],
[
0,
2.344931,
0
],
[
0,
0,
2.344931
]
] | -29.739186 | [
3.588,
0.17,
-0.115,
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] | [
[
0,
0,
0
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[
0,
0,
0
],
[
0,
0,
0
],
[
0,
0,
0
]
] | 3.659288 | 2.454257 | pbe | true | 2804ff37980d8afc47cfe7328c3989ea_225_Er2Mn1Os1 |
[
"Er",
"Mn",
"V"
] | 19 | A16B2C | Er2Mn16V | Er2 Mn16 V1 | 3 | [
1,
1,
1
] | 3 | [
[
6.28985971,
-0.1332636,
0.56074344
],
[
0.50107858,
6.27128489,
0.56074449
],
[
-0.14743916,
-0.13326359,
6.31308396
]
] | agm005820593 | [
[
4.290827814369275,
3.878284749276105,
4.801756909922249
],
[
2.3464861515057045,
2.1208824612576183,
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2.1056898116902416,
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],
[
1.0133982248438296,
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4.476606031717235
],
[
4.334894066462227,
3.9181142456994262,
1.5085326980717828
],
[
6.387760796802616,
2.8674010222179884,
7.14838152728216
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[
3.496339992297929,
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[
6.711686964231642,
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[
0.6778995287806089,
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0.7586202214068117
],
[
6.003232034216232,
5.426049296757654,
6.718065172792688
]
] | [{"mass": null, "name": "Mn", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Mn"]}, {"mass": null, "name": "Er", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Er"]}, {"mass": null, "name": "V", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["V"]}] | [
"Er",
"Er",
"Mn",
"Mn",
"Mn",
"Mn",
"Mn",
"Mn",
"Mn",
"Mn",
"Mn",
"Mn",
"Mn",
"Mn",
"Mn",
"Mn",
"Mn",
"Mn",
"V"
] | 2023-11-16 06:57:59 | [
0.10526315789473684,
0.8421052631578947,
0.05263157894736842
] | [
[
3.545041,
0.2635768,
0.3263375
],
[
0.2635768,
3.491662,
0.2949622
],
[
0.3263375,
0.2949622,
3.6186233
]
] | -165.307338 | [
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2.201,
2.201,
2.177,
2.177,
2.177,
0.321,
0.321,
0.321,
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] | [
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[
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[
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[
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0.00349238,
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[
0.00385283,
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[
0.003452,
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[
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0.0031684,
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[
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[
0.00189488,
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0.00212051
],
[
-0.00171114,
-0.00154662,
-0.00191489
]
] | 6.088537 | 21.856861 | pbe | true | 1fcfb9223349c43e6f79dcfabb351d02_160_Er2Mn16V1 |
[
"Er",
"Mn",
"Zn"
] | 18 | A6B2C | Er6Mn2Zn | Er12 Mn4 Zn2 | 3 | [
1,
1,
1
] | 3 | [
[
7.74450333,
0.11675165,
-2.83931294
],
[
-4.02245862,
6.78274477,
-2.42216623
],
[
-0.09881139,
-0.11675271,
8.24798646
]
] | agm005805081 | [
[
1.163057314178711,
4.855286719042453,
3.451568579673272
],
[
2.4601760058212894,
1.9274569909575465,
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[
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[
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[
2.1987621369491634,
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[
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[
0.6898677302420724,
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],
[
2.9333655897579276,
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2.0751054207139408
],
[
-2.060635005,
3.33299603,
2.912910115
],
[
0,
0,
0
]
] | [{"mass": null, "name": "Mn", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Mn"]}, {"mass": null, "name": "Er", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Er"]}, {"mass": null, "name": "Zn", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Zn"]}] | [
"Er",
"Er",
"Er",
"Er",
"Er",
"Er",
"Er",
"Er",
"Er",
"Er",
"Er",
"Er",
"Mn",
"Mn",
"Mn",
"Mn",
"Zn",
"Zn"
] | 2023-11-16 06:57:59 | [
0.6666666666666666,
0.2222222222222222,
0.1111111111111111
] | [
[
1.2888381,
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],
[
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1.2383208,
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],
[
0.00916881,
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1.2823635
]
] | -94.511434 | [
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0.007,
0.007,
0.007,
0.007,
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0.88,
0.88,
1.373,
1.373,
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] | [
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[
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[
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[
0.0015822,
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[
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[
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[
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[
0.00089129,
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[
0.00009921,
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],
[
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[
0.00217038,
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[
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[
0.00394622,
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[
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0,
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],
[
0,
0,
0
],
[
0,
0,
0
]
] | 3.701743 | 19.47365 | pbe | true | 04961c33aac9dabb970439598769fd3d_71_Er12Mn4Zn2 |
[
"Er",
"Mo",
"Tc"
] | 4 | A2BC | ErMoTc2 | Er1 Tc2 Mo1 | 3 | [
1,
1,
1
] | 3 | [
[
3.19805046,
0,
0
],
[
0,
3.19805046,
0
],
[
0,
0,
6.77558843
]
] | agm001150808 | [
[
1.59902523,
1.59902523,
0
],
[
0,
0,
5.289944250099142
],
[
0,
0,
1.4856441799008588
],
[
1.59902523,
1.59902523,
3.387794215
]
] | [{"mass": null, "name": "Mo", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Mo"]}, {"mass": null, "name": "Tc", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Tc"]}, {"mass": null, "name": "Er", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Er"]}] | [
"Mo",
"Tc",
"Tc",
"Er"
] | 2023-11-16 06:57:59 | [
0.25,
0.25,
0.5
] | [
[
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0
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[
0,
5.4720297,
0
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[
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] | -36.16874 | [
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[
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[
0,
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[
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0
]
] | 0.000016 | 3.847283 | pbe | true | 343f1f9fbb67a39d517bd11cb4095af6_123_Er1Tc2Mo1 |
[
"Er",
"Nd",
"Pr"
] | 8 | A4B3C | Er3Nd4Pr | Pr1 Nd4 Er3 | 3 | [
1,
1,
1
] | 3 | [
[
3.40099594,
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[
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]
] | agm005911681 | [
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"Pr",
"Nd",
"Nd",
"Nd",
"Nd",
"Er",
"Er",
"Er"
] | 2023-11-16 06:57:59 | [
0.375,
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0.125
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[
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[
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] | 0.000956 | 14.521808 | pbe | true | 555803ced2e9729b18ff058e44cfafef_71_Pr1Nd4Er3 |
[
"Er",
"Nd",
"Pr"
] | 12 | A9B2C | Er9NdPr2 | Pr2 Nd1 Er9 | 3 | [
1,
1,
1
] | 3 | [
[
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0,
0
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[
0,
11.25869204,
0
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[
0,
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] | agm003536807 | [
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] | [{"mass": null, "name": "Pr", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Pr"]}, {"mass": null, "name": "Nd", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Nd"]}, {"mass": null, "name": "Er", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Er"]}] | [
"Pr",
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"Nd",
"Er",
"Er",
"Er",
"Er",
"Er",
"Er",
"Er",
"Er",
"Er"
] | 2023-11-16 06:57:59 | [
0.75,
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[
0,
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] | 0.000457 | 18.943348 | pbe | true | 27cc0d8a6b26cb846803eb4af346ae60_191_Pr2Nd1Er9 |
[
"Er",
"Nd",
"Pr"
] | 16 | A14BC | Er14NdPr | Pr1 Nd1 Er14 | 3 | [
1,
1,
1
] | 3 | [
[
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0
],
[
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[
0,
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[
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] | [{"mass": null, "name": "Pr", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Pr"]}, {"mass": null, "name": "Nd", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Nd"]}, {"mass": null, "name": "Er", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Er"]}] | [
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"Er",
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"Er",
"Er",
"Er",
"Er",
"Er",
"Er",
"Er",
"Er",
"Er",
"Er"
] | 2023-11-16 06:57:59 | [
0.875,
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[
-0.00223525,
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] | 0.000001 | 20.897835 | pbe | true | 2ac70fa1ce8f4c7df07581f57c8eff06_38_Pr1Nd1Er14 |
[
"Er",
"Nd",
"S"
] | 7 | A3B2C2 | Er2Nd2S3 | Nd2 Er2 S3 | 3 | [
1,
1,
1
] | 3 | [
[
3.87098724,
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[
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6.39998678,
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[
0.00297978,
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]
] | agm005554555 | [
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] | [{"mass": null, "name": "S", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["S"]}, {"mass": null, "name": "Nd", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Nd"]}, {"mass": null, "name": "Er", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Er"]}] | [
"Nd",
"Nd",
"Er",
"Er",
"S",
"S",
"S"
] | 2023-11-16 06:57:59 | [
0.2857142857142857,
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[
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] | -42.964801 | [
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[
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]
] | 0.000244 | 3.139668 | pbe | true | 80d971cb32fa4f2930be51d42201b811_2_Nd2Er2S3 |
[
"Er",
"Nd",
"Sn"
] | 4 | A2BC | ErNdSn2 | Nd1 Er1 Sn2 | 3 | [
1,
1,
1
] | 3 | [
[
3.49666795,
0,
0
],
[
0,
3.49666795,
0
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[
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] | agm001128840 | [
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[
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[
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[
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] | [{"mass": null, "name": "Sn", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Sn"]}, {"mass": null, "name": "Nd", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Nd"]}, {"mass": null, "name": "Er", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Er"]}] | [
"Nd",
"Sn",
"Sn",
"Er"
] | 2023-11-16 06:57:59 | [
0.25,
0.25,
0.5
] | [
[
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[
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[
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] | -19.875255 | [
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[
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[
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]
] | 0.000161 | 3.451888 | pbe | true | e560a3d8f2d448b52263d1eb89d9c2f3_123_Nd1Er1Sn2 |
[
"Er",
"Nd",
"Tb"
] | 7 | A4B2C | Er2NdTb4 | Tb4 Nd1 Er2 | 3 | [
1,
1,
1
] | 3 | [
[
3.50902001,
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[
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] | agm005873378 | [
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] | [{"mass": null, "name": "Tb", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Tb"]}, {"mass": null, "name": "Nd", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Nd"]}, {"mass": null, "name": "Er", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Er"]}] | [
"Tb",
"Tb",
"Tb",
"Tb",
"Nd",
"Er",
"Er"
] | 2023-11-16 06:57:59 | [
0.2857142857142857,
0.14285714285714285,
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] | [
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[
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[
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]
] | -32.186513 | [
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[
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] | -0.000001 | 10.356973 | pbe | true | da362153cf563de9bb8805409c362227_12_Tb4Nd1Er2 |
[
"Er",
"Nd",
"Tb"
] | 12 | A7B3C2 | Er3Nd7Tb2 | Tb2 Nd7 Er3 | 3 | [
1,
1,
1
] | 3 | [
[
3.56609065,
0,
0
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[
0,
6.41141511,
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[
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] | agm005609820 | [
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] | [{"mass": null, "name": "Tb", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Tb"]}, {"mass": null, "name": "Nd", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Nd"]}, {"mass": null, "name": "Er", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Er"]}] | [
"Tb",
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"Nd",
"Nd",
"Nd",
"Nd",
"Nd",
"Nd",
"Nd",
"Er",
"Er",
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] | 2023-11-16 06:57:59 | [
0.25,
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[
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] | -55.499887 | [
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[
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[
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[
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[
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[
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[
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[
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[
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[
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[
-0.00069147,
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]
] | 3.999608 | 2.946887 | pbe | true | 2023d640db49e5a67d2e6754f1c22236_62_Er4Ni4O12 |
[
"Er",
"Ni",
"P"
] | 6 | ABC | ErNiP | Er2 Ni2 P2 | 3 | [
1,
1,
1
] | 3 | [
[
3.85414007,
0.00037687,
-0.00185177
],
[
0.0003769,
3.85419653,
-0.0017539
],
[
-1.92504008,
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6.71669478
]
] | agm002233270 | [
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"Ni",
"Ni",
"P",
"P",
"Er",
"Er"
] | 2023-11-16 06:57:59 | [
0.3333333333333333,
0.3333333333333333,
0.3333333333333333
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[
0.11552331,
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[
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0.00101539,
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[
0.00002268,
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]
] | 0 | 3.705457 | pbe | true | ce5a7de9f142d8b70d8a7214d7576559_109_Er2Ni2P2 |
[
"Er",
"Ni",
"Tm"
] | 10 | A2B2C | ErNi2Tm2 | Er2 Tm4 Ni4 | 3 | [
1,
1,
1
] | 3 | [
[
3.58160756,
0,
-0.54909996
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[
0,
4.08447569,
0
],
[
0.49443607,
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15.18044844
]
] | agm005904005 | [
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"Er",
"Er",
"Tm",
"Tm",
"Tm",
"Tm",
"Ni",
"Ni",
"Ni",
"Ni"
] | 2023-11-16 06:57:59 | [
0.2,
0.4,
0.4
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[
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] | -53.372894 | [
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] | 0.000001 | 8.657256 | pbe | true | f6df398cb477a1668357c54ecf069d90_63_Er2Tm4Ni4 |
[
"Er",
"Ni",
"Zn"
] | 4 | A2BC | Er2NiZn | Er2 Zn1 Ni1 | 3 | [
1,
1,
1
] | 3 | [
[
3.42978956,
0,
0
],
[
0,
3.42978956,
0
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[
0,
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] | agm001134956 | [
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[
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"Ni",
"Zn",
"Er",
"Er"
] | 2023-11-16 06:57:59 | [
0.5,
0.25,
0.25
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[
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0
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[
0,
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[
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] | -17.786654 | [
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[
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[
0,
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[
0,
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]
] | -0.000002 | 3.440608 | pbe | true | 3c0fc4624a5fdf63ec377488014b154c_123_Er2Zn1Ni1 |
[
"Er",
"O",
"Tl"
] | 20 | A3BC | ErO3Tl | Er4 Tl4 O12 | 3 | [
1,
1,
1
] | 3 | [
[
6.03353278,
0,
0
],
[
0,
6.75458881,
0.26027056
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[
0,
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] | agm003725945 | [
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[
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[
2.0870926893660733,
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] | [{"mass": null, "name": "O", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["O"]}, {"mass": null, "name": "Tl", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Tl"]}, {"mass": null, "name": "Er", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Er"]}] | [
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"O",
"O",
"O",
"O",
"O",
"O",
"O",
"O",
"O",
"O",
"O",
"O"
] | 2023-11-16 06:57:59 | [
0.2,
0.6,
0.2
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0
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[
0,
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[
0,
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0,
0,
0,
0,
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0,
0,
0,
0,
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[
-0.00190915,
0.00138043,
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]
] | -0 | -0.151374 | pbe | true | 42f0246f2d35465e19e255e33d60b866_14_Er4Tl4O12 |
[
"Er",
"P",
"Pr"
] | 4 | A2BC | Er2PPr | Pr1 Er2 P1 | 3 | [
1,
1,
1
] | 3 | [
[
3.71364631,
0,
0
],
[
1.85682316,
3.21611205,
0
],
[
1.85682316,
1.07203735,
10.29765418
]
] | agm001968769 | [
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0
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[
3.713646315,
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[
1.8568250342474584,
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] | [{"mass": null, "name": "Pr", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Pr"]}, {"mass": null, "name": "Er", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Er"]}, {"mass": null, "name": "P", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["P"]}] | [
"Pr",
"P",
"Er",
"Er"
] | 2023-11-16 06:57:59 | [
0.5,
0.25,
0.25
] | [
[
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[
0,
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[
0,
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]
] | -21.50677 | [
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] | [
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[
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[
0,
0,
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[
0,
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] | -0.000022 | 5.111138 | pbe | true | 499920c15e470c7788016dbb57d47d01_166_Pr1Er2P1 |
[
"Er",
"P",
"Rh"
] | 12 | ABC | ErPRh | Er4 P4 Rh4 | 3 | [
1,
1,
1
] | 3 | [
[
4.03915689,
0,
0
],
[
-2.01957844,
3.49801247,
0
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[
0,
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15.53118955
]
] | agm002350112 | [
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] | [{"mass": null, "name": "Er", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Er"]}, {"mass": null, "name": "Rh", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Rh"]}, {"mass": null, "name": "P", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["P"]}] | [
"P",
"P",
"P",
"P",
"Rh",
"Rh",
"Rh",
"Rh",
"Er",
"Er",
"Er",
"Er"
] | 2023-11-16 06:57:59 | [
0.3333333333333333,
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[
0,
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[
0,
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] | -83.973852 | [
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0,
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[
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[
0,
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[
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]
] | -0.000015 | 8.115879 | pbe | true | be212875d52422bc5ad67bc3bc72bc9c_194_Er4P4Rh4 |
[
"Er",
"Pb",
"Tb"
] | 11 | A5B4C2 | Er2Pb4Tb5 | Tb5 Er2 Pb4 | 3 | [
1,
1,
1
] | 3 | [
[
3.52660112,
0,
0
],
[
0,
7.43538705,
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[
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]
] | agm003363747 | [
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1.7633005600300553e-8,
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] | [{"mass": null, "name": "Tb", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Tb"]}, {"mass": null, "name": "Pb", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Pb"]}, {"mass": null, "name": "Er", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Er"]}] | [
"Tb",
"Tb",
"Tb",
"Tb",
"Tb",
"Er",
"Er",
"Pb",
"Pb",
"Pb",
"Pb"
] | 2023-11-16 06:57:59 | [
0.18181818181818182,
0.36363636363636365,
0.45454545454545453
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[
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[
0,
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] | -48.274766 | [
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[
0,
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]
] | 0.000658 | 11.489057 | pbe | true | 86702a4a122394d58dc347b3eb136ba4_12_Tb5Er2Pb4 |
[
"Er",
"Tb",
"Th"
] | 16 | A12B3C | Er12Tb3Th | Tb3 Er12 Th1 | 3 | [
1,
1,
1
] | 3 | [
[
4.98431513,
0,
0
],
[
0,
4.98431731,
0
],
[
0,
0,
19.90066481
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] | agm005937273 | [
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0,
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[
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] | [{"mass": null, "name": "Tb", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Tb"]}, {"mass": null, "name": "Th", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Th"]}, {"mass": null, "name": "Er", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Er"]}] | [
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"Er",
"Er",
"Er",
"Er",
"Er",
"Er",
"Er",
"Er",
"Er",
"Er",
"Er",
"Th"
] | 2023-11-16 06:57:59 | [
0.75,
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0.0625
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[
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[
0,
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[
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[
0,
0,
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[
0,
0,
0
]
] | 0.000001 | 22.035103 | pbe | true | c30c81ff8bda3d8f05a12b740a233853_123_Tb3Er12Th1 |
[
"Er",
"Pb",
"V"
] | 4 | A2BC | ErPb2V | Er1 V1 Pb2 | 3 | [
1,
1,
1
] | 3 | [
[
5.4805264,
0.44070753,
0.32471284
],
[
3.19596111,
4.812234,
0.61590063
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[
3.18719484,
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4.34288135
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] | agm002358988 | [
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11.719855445572684,
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6.075658547424869,
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] | [{"mass": null, "name": "Pb", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Pb"]}, {"mass": null, "name": "Er", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Er"]}, {"mass": null, "name": "V", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["V"]}] | [
"Pb",
"Pb",
"V",
"Er"
] | 2023-11-16 06:57:59 | [
0.25,
0.5,
0.25
] | [
[
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[
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[
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] | -20.773077 | [
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2.296,
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[
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[
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[
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] | 2.494216 | 3.143402 | pbe | true | e44270d36103c092e3ab13586379dd2a_12_Er1V1Pb2 |
[
"Er",
"Pd",
"Pm"
] | 6 | A3B2C | Er2Pd3Pm | Pm1 Er2 Pd3 | 3 | [
1,
1,
1
] | 3 | [
[
3.50248486,
0,
0
],
[
0,
3.50248486,
0
],
[
0,
0,
10.63870963
]
] | agm003439282 | [
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[
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] | [{"mass": null, "name": "Er", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Er"]}, {"mass": null, "name": "Pm", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Pm"]}, {"mass": null, "name": "Pd", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Pd"]}] | [
"Pm",
"Er",
"Er",
"Pd",
"Pd",
"Pd"
] | 2023-11-16 06:57:59 | [
0.3333333333333333,
0.5,
0.16666666666666666
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[
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0
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[
0,
2.5688624,
0
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[
0,
0,
2.8287244
]
] | -34.665637 | [
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0,
0,
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[
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[
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[
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[
0,
0,
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[
0,
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] | -0.000002 | 4.142179 | pbe | true | b5ff9872645bb86f1aa9257b939da86f_123_Pm1Er2Pd3 |
[
"Er",
"Pd",
"Sb"
] | 11 | A8B2C | Er2Pd8Sb | Er2 Sb1 Pd8 | 3 | [
1,
1,
1
] | 3 | [
[
4.71561268,
0,
0
],
[
0,
5.908634,
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[
-2.35780634,
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] | agm003532742 | [
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[
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] | [{"mass": null, "name": "Sb", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Sb"]}, {"mass": null, "name": "Er", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Er"]}, {"mass": null, "name": "Pd", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Pd"]}] | [
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"Er",
"Sb",
"Pd",
"Pd",
"Pd",
"Pd",
"Pd",
"Pd",
"Pd",
"Pd"
] | 2023-11-16 06:57:59 | [
0.18181818181818182,
0.7272727272727273,
0.09090909090909091
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[
3.697644,
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0
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[
0,
3.8343074,
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],
[
0,
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] | -62.286548 | [
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0,
0,
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[
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[
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[
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[
0,
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[
0,
0.00069695,
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]
] | 0.000001 | 3.810923 | pbe | true | 38ca7232e91909e6b5c58545dff25f8c_71_Er2Sb1Pd8 |
[
"Er",
"Tm",
"Y"
] | 19 | A12B6C | Er6TmY12 | Y12 Er6 Tm1 | 3 | [
1,
1,
1
] | 3 | [
[
8.43771219,
0.75624348,
0.90596133
],
[
-0.53168322,
8.45483318,
0.90596135
],
[
-0.5316832,
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] | agm003688936 | [
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[
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[
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[
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0
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] | [{"mass": null, "name": "Er", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Er"]}, {"mass": null, "name": "Tm", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Tm"]}, {"mass": null, "name": "Y", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Y"]}] | [
"Y",
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"Y",
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"Y",
"Y",
"Y",
"Y",
"Y",
"Er",
"Er",
"Er",
"Er",
"Er",
"Er",
"Tm"
] | 2023-11-16 06:57:59 | [
0.3157894736842105,
0.05263157894736842,
0.631578947368421
] | [
[
1.8931814,
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[
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[
-0.05223043,
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] | -106.51207 | [
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0.01,
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0.01,
0.01,
0.01,
0.01,
0.002,
0.002,
0.002,
0.002,
0.002,
0.002,
0.012
] | [
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[
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[
0.00177213,
0.00354028,
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[
0,
0,
0
]
] | 0.176238 | 35.1786 | pbe | true | 5e64e065b8f8122d854acc31e5c8e942_148_Y12Er6Tm1 |
[
"Er",
"Pd",
"Zn"
] | 6 | A4BC | ErPdZn4 | Er1 Zn4 Pd1 | 3 | [
1,
1,
1
] | 3 | [
[
5.18628589,
0,
0
],
[
2.59314294,
4.49145533,
0
],
[
2.59314294,
1.49715178,
4.2345847
]
] | agm001187967 | [
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[
5.186288479400909,
1.4876141434163628,
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[
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[
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] | [{"mass": null, "name": "Pd", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Pd"]}, {"mass": null, "name": "Er", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Er"]}, {"mass": null, "name": "Zn", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Zn"]}] | [
"Zn",
"Zn",
"Zn",
"Zn",
"Pd",
"Er"
] | 2023-11-16 06:57:59 | [
0.16666666666666666,
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0.6666666666666666
] | [
[
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0
],
[
0,
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],
[
0,
0,
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]
] | -17.173594 | [
0,
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] | [
[
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[
0,
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[
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[
0.0014343,
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],
[
0,
0,
0
],
[
0,
0,
0
]
] | 0.000008 | 4.044435 | pbe | true | 471a6d0a8dd5f322beebd9ee15938ab7_216_Er1Zn4Pd1 |
[
"Er",
"Pd",
"Zn"
] | 8 | A4B3C | ErPd4Zn3 | Er1 Zn3 Pd4 | 3 | [
1,
1,
1
] | 3 | [
[
4.27834177,
1e-8,
1.26291594
],
[
1.95277225,
3.80669008,
1.26291595
],
[
-0.00895369,
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7.90859556
]
] | agm005949305 | [
[
1.5431676901790277,
0.942746462757879,
2.6505205242030727
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[
4.678992639820971,
2.8584733872421206,
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3.817736219091342,
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[
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] | [{"mass": null, "name": "Pd", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Pd"]}, {"mass": null, "name": "Er", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Er"]}, {"mass": null, "name": "Zn", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Zn"]}] | [
"Zn",
"Zn",
"Zn",
"Pd",
"Pd",
"Pd",
"Pd",
"Er"
] | 2023-11-16 06:57:59 | [
0.125,
0.5,
0.375
] | [
[
7.257686,
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[
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],
[
0.01730299,
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]
] | -34.306727 | [
0,
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0,
0,
0,
0
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[
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[
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[
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[
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[
-0.00030791,
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[
0,
0,
0
]
] | 0 | 3.767311 | pbe | true | cae9eeaec9f7a32d3910bbad32fda292_166_Er1Zn3Pd4 |
[
"Er",
"Pm",
"Si"
] | 4 | A2BC | Er2PmSi | Pm1 Er2 Si1 | 3 | [
1,
1,
1
] | 3 | [
[
4.76863769,
0,
0
],
[
2.38431884,
4.12976138,
0
],
[
2.38431884,
1.37658713,
5.55952064
]
] | agm001933697 | [
[
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2.77976032
],
[
0,
0,
0
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[
7.152956527760904,
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3.7344911287961473
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[
2.3843188422390966,
1.3765871277609034,
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]
] | [{"mass": null, "name": "Er", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Er"]}, {"mass": null, "name": "Pm", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Pm"]}, {"mass": null, "name": "Si", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Si"]}] | [
"Si",
"Pm",
"Er",
"Er"
] | 2023-11-16 06:57:59 | [
0.5,
0.25,
0.25
] | [
[
0.21341445,
0,
0
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[
0,
0.21341445,
0
],
[
0,
0,
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]
] | -19.328566 | [
0,
0,
0,
0
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[
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[
0,
0,
0
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[
0,
0,
0.00207222
],
[
0,
0,
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]
] | 0.000734 | 4.419479 | pbe | true | 33d2bea1af2f565c40352661c1ae7142_166_Pm1Er2Si1 |
[
"Er",
"Pm",
"Sm"
] | 4 | A2BC | ErPmSm2 | Pm1 Sm2 Er1 | 3 | [
1,
1,
1
] | 3 | [
[
3.61918873,
0,
0
],
[
1.80959436,
3.13430938,
0
],
[
1.80959436,
1.04476979,
11.686884
]
] | agm005128901 | [
[
3.6191887430958483,
2.0895395954476026,
5.8437762448824
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[
1.8095943608186824,
1.0447697908186824,
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[
1.8095943806096444,
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2.8736848681701597
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[
5.428781295169296,
3.1343083423456197,
11.68320742316244
]
] | [{"mass": null, "name": "Er", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Er"]}, {"mass": null, "name": "Pm", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Pm"]}, {"mass": null, "name": "Sm", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Sm"]}] | [
"Pm",
"Sm",
"Sm",
"Er"
] | 2023-11-16 06:57:59 | [
0.25,
0.25,
0.5
] | [
[
1.2599412,
0,
0
],
[
0,
1.2599412,
0
],
[
0,
0,
1.3410319
]
] | -18.68279 | [
-0.001,
0,
-0.001,
0
] | [
[
0,
0,
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[
0,
0,
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],
[
0,
0,
0.00708551
],
[
0,
0,
0.00496153
]
] | -0.00479 | 5.814726 | pbe | true | 3c08520a5681063968c16381b5f77b4d_160_Pm1Sm2Er1 |
[
"Er",
"Pm",
"Sr"
] | 4 | A2BC | ErPm2Sr | Sr1 Pm2 Er1 | 3 | [
1,
1,
1
] | 3 | [
[
4.08794506,
0,
0
],
[
0,
4.08794506,
0
],
[
0,
0,
9.15754939
]
] | agm001156870 | [
[
2.04397253,
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4.578774695
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[
0,
0,
7.284393083610639
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[
0,
0,
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],
[
2.04397253,
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0
]
] | [{"mass": null, "name": "Er", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Er"]}, {"mass": null, "name": "Pm", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Pm"]}, {"mass": null, "name": "Sr", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Sr"]}] | [
"Sr",
"Pm",
"Pm",
"Er"
] | 2023-11-16 06:57:59 | [
0.25,
0.5,
0.25
] | [
[
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0,
0
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[
0,
0.73597735,
0
],
[
0,
0,
0.89012134
]
] | -15.256009 | [
0,
0,
0,
0
] | [
[
0,
0,
0
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[
0,
0,
0.00591516
],
[
0,
0,
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[
0,
0,
0
]
] | 0.000093 | 4.955944 | pbe | true | 564d1fc32d4cbee6ea9307356b5a5265_123_Sr1Pm2Er1 |
[
"Er",
"Pm",
"Th"
] | 10 | A5B4C | Er5Pm4Th | Pm4 Er5 Th1 | 3 | [
1,
1,
1
] | 3 | [
[
5.33308607,
2e-8,
-1.21916616
],
[
-0.02676914,
10.41533519,
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],
[
-1.36252719,
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6.31383046
]
] | agm006070292 | [
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3.1046337712453127,
2.657036302363163,
1.3067872753089054
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[
0.11219678007677211,
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[
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[
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9.847489507163385,
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[
2.666543035,
1e-8,
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] | [{"mass": null, "name": "Th", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Th"]}, {"mass": null, "name": "Er", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Er"]}, {"mass": null, "name": "Pm", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Pm"]}] | [
"Pm",
"Pm",
"Pm",
"Pm",
"Er",
"Er",
"Er",
"Er",
"Er",
"Th"
] | 2023-11-16 06:57:59 | [
0.5,
0.4,
0.1
] | [
[
0.45078832,
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[
0.00825,
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],
[
-0.00764379,
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0.4190987
]
] | -47.335042 | [
0,
0,
0,
0,
0,
0,
0,
0,
0,
0
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[
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0,
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[
-0.00060764,
0.00252644,
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[
0,
0,
0
]
] | -0.000003 | 15.313983 | pbe | true | 2bd516eee68788f20cb64fc5c7c38db2_12_Pm4Er5Th1 |
[
"Er",
"Pm",
"Tm"
] | 26 | A6B5C2 | Er6Pm5Tm2 | Pm10 Er12 Tm4 | 3 | [
1,
1,
1
] | 3 | [
[
3.56972107,
0,
0
],
[
0,
11.56646351,
9.8e-7
],
[
0,
0.0000011,
20.40377916
]
] | agm005670051 | [
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1.784860535,
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9.170819786452055
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1.784860535,
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[
0,
9.592888828518127,
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[
0,
1.9735757814818717,
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] | [{"mass": null, "name": "Tm", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Tm"]}, {"mass": null, "name": "Er", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Er"]}, {"mass": null, "name": "Pm", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Pm"]}] | [
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"Er",
"Er",
"Er",
"Er",
"Er",
"Er",
"Er",
"Tm",
"Tm",
"Tm",
"Tm"
] | 2023-11-16 06:57:59 | [
0.46153846153846156,
0.38461538461538464,
0.15384615384615385
] | [
[
1.1749427,
0,
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],
[
0,
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1.6e-7
],
[
0,
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] | -117.643718 | [
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[
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0,
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[
0,
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0,
0.00211189,
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[
0,
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]
] | -0.000088 | 31.736553 | pbe | true | 2f3356e8015d0b44893205b2256a531d_55_Pm10Er12Tm4 |
[
"Er",
"Pm",
"Y"
] | 11 | A4B4C3 | Er3Pm4Y4 | Pm4 Y4 Er3 | 3 | [
1,
1,
1
] | 3 | [
[
3.53866621,
-0.00006654,
0.00246722
],
[
0.00012635,
5.63471063,
0.00365279
],
[
1.76055,
2.80102771,
17.92175373
]
] | agm003377856 | [
[
3.5312504432400527,
5.625310522862682,
16.28208983866387
],
[
1.7680997681907198,
2.8103808674743864,
1.6446577284182295
],
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5.627314694327682,
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3.5336323988080474,
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[
1.7644362873476944,
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[
3.535023612416094,
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],
[
1.7605568656276132,
2.80100071852649,
17.921321159619293
]
] | [{"mass": null, "name": "Er", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Er"]}, {"mass": null, "name": "Pm", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Pm"]}, {"mass": null, "name": "Y", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Y"]}] | [
"Pm",
"Pm",
"Pm",
"Pm",
"Y",
"Y",
"Y",
"Y",
"Er",
"Er",
"Er"
] | 2023-11-16 06:57:59 | [
0.2727272727272727,
0.36363636363636365,
0.36363636363636365
] | [
[
1.4204223,
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[
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1.4262897,
0.00221751
],
[
-0.00410881,
0.00221758,
1.4806778
]
] | -57.954361 | [
0,
0,
0,
0,
0,
0,
0,
0,
0,
0,
0
] | [
[
-0.00030363,
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[
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[
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[
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[
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[
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[
0.00038116,
0.00083459,
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],
[
0.00002466,
0.00007384,
0.00110753
]
] | -0.000006 | 19.59708 | pbe | true | 90e8517190fdb46241a90b64a4232f23_2_Pm4Y4Er3 |
[
"Er",
"Pr",
"Sm"
] | 6 | A4BC | ErPrSm4 | Pr1 Sm4 Er1 | 3 | [
1,
1,
1
] | 3 | [
[
6.66815301,
0,
0
],
[
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1
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[
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1
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[
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1,
1
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] | -0.046824 | 20.491455 | pbe | true | 6fb33decad9765e62392fce0dd813767_123_Pr3Er12Tl1 |
[
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1,
1
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] | -0.000002 | 14.063381 | pbe | true | 7a7b76b8d41ba1d98824435debd7073f_12_Pr2Er8Tm1 |
[
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1,
1,
1
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1.039004
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] | -20.505335 | [
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] | -0.000965 | 6.111903 | pbe | true | 668d4c59794836eccc1df6197acf5fc5_123_Pr2Y1Er1 |
[
"Er",
"Pr",
"Y"
] | 20 | A12B7C | ErPr12Y7 | Pr12 Y7 Er1 | 3 | [
1,
1,
1
] | 3 | [
[
8.64850376,
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1.72926451
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[
-1.29813878,
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[
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] | agm003702222 | [
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[
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] | [{"mass": null, "name": "Pr", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Pr"]}, {"mass": null, "name": "Er", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Er"]}, {"mass": null, "name": "Y", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Y"]}] | [
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"Pr",
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"Y",
"Y",
"Y",
"Y",
"Y",
"Y",
"Y",
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] | 2023-11-16 06:57:59 | [
0.05,
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[
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]
] | -0.000606 | 39.32778 | pbe | true | 62a29fe318fbcfae34e653992d740928_148_Pr12Y7Er1 |
[
"Er",
"Pt",
"Tb"
] | 18 | A4B3C2 | Er3Pt4Tb2 | Tb4 Er6 Pt8 | 3 | [
1,
1,
1
] | 3 | [
[
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0
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[
-2.53205555,
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0
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[
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] | [{"mass": null, "name": "Tb", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Tb"]}, {"mass": null, "name": "Er", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Er"]}, {"mass": null, "name": "Pt", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Pt"]}] | [
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"Er",
"Er",
"Er",
"Er",
"Pt",
"Pt",
"Pt",
"Pt",
"Pt",
"Pt",
"Pt",
"Pt"
] | 2023-11-16 06:57:59 | [
0.3333333333333333,
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[
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[
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] | -0.000004 | 9.9374 | pbe | true | 36c5254e0dbec23d6763b01c28fb9202_14_Tb4Er6Pt8 |
[
"Er",
"Pu",
"Ru"
] | 7 | A3B2C2 | Er2Pu2Ru3 | Er2 Pu2 Ru3 | 3 | [
1,
1,
1
] | 3 | [
[
4.45286939,
-0.00037321,
-1.24330535
],
[
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3.95175898,
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[
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]
] | agm005558033 | [
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] | [{"mass": null, "name": "Er", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Er"]}, {"mass": null, "name": "Pu", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Pu"]}, {"mass": null, "name": "Ru", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Ru"]}] | [
"Er",
"Er",
"Pu",
"Pu",
"Ru",
"Ru",
"Ru"
] | 2023-11-16 06:57:59 | [
0.2857142857142857,
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] | [
[
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[
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] | -67.289531 | [
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0.673,
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] | [
[
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[
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]
] | -8.602178 | 12.586994 | pbe | true | 30927573c24992d05126351f563d25d4_166_Er2Pu2Ru3 |
[
"Er",
"Pu",
"Si"
] | 4 | A2BC | ErPu2Si | Er1 Pu2 Si1 | 3 | [
1,
1,
1
] | 3 | [
[
3.43534974,
0,
0
],
[
1.71767487,
2.97510014,
0
],
[
1.71767487,
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] | agm001933701 | [
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[
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] | [{"mass": null, "name": "Pu", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Pu"]}, {"mass": null, "name": "Er", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Er"]}, {"mass": null, "name": "Si", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Si"]}] | [
"Si",
"Er",
"Pu",
"Pu"
] | 2023-11-16 06:57:59 | [
0.25,
0.5,
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] | [
[
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[
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[
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] | -38.320911 | [
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[
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[
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] | 11.502266 | 13.831464 | pbe | true | 32d7d8ac8750490e031963a2889b7500_166_Er1Pu2Si1 |
[
"Er",
"Pu",
"Sm"
] | 20 | A12B7C | Er12PuSm7 | Sm7 Er12 Pu1 | 3 | [
1,
1,
1
] | 3 | [
[
7.7080771,
3.66708492,
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[
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[
0.50770153,
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] | agm005809937 | [
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[
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[
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] | [{"mass": null, "name": "Pu", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Pu"]}, {"mass": null, "name": "Er", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Er"]}, {"mass": null, "name": "Sm", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Sm"]}] | [
"Sm",
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"Sm",
"Sm",
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"Sm",
"Er",
"Er",
"Er",
"Er",
"Er",
"Er",
"Er",
"Er",
"Er",
"Er",
"Er",
"Er",
"Pu"
] | 2023-11-16 06:57:59 | [
0.6,
0.05,
0.35
] | [
[
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[
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[
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] | -99.80922 | [
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[
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[
-0.00007705,
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[
0,
0,
0
]
] | 5.599884 | 30.8293 | pbe | true | 0e3813781435fe634d04e09d1d874f1c_2_Sm7Er12Pu1 |
[
"Er",
"Pu",
"Tm"
] | 3 | ABC | ErPuTm | Er1 Tm1 Pu1 | 3 | [
1,
1,
1
] | 3 | [
[
3.29418787,
0,
0
],
[
0,
5.5164342,
0
],
[
0,
-2.7582171,
4.77737216
]
] | agm001276427 | [
[
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],
[
0.549254536817364,
2.758217127582171,
1.5924573707420926
],
[
0.5487492742818635,
0,
0
]
] | [{"mass": null, "name": "Er", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Er"]}, {"mass": null, "name": "Tm", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Tm"]}, {"mass": null, "name": "Pu", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Pu"]}] | [
"Er",
"Tm",
"Pu"
] | 2023-11-16 06:57:59 | [
0.3333333333333333,
0.3333333333333333,
0.3333333333333333
] | [
[
2.8760793,
0,
0
],
[
0,
2.5692294,
0
],
[
0,
0,
2.5692294
]
] | -22.865556 | [
-0.149,
-0.139,
-5.544
] | [
[
-0.00038481,
0,
0
],
[
0.00009128,
0,
0
],
[
0.00029353,
0,
0
]
] | -6.180208 | 9.418055 | pbe | true | 934f0e1a4de47b703f374f64e1695856_187_Er1Tm1Pu1 |
[
"Er",
"Pu",
"Tm"
] | 11 | A8B2C | Er2PuTm8 | Er2 Tm8 Pu1 | 3 | [
1,
1,
1
] | 3 | [
[
4.91544336,
0,
0
],
[
0,
7.76513442,
0.51323361
],
[
-2.45772168,
-2.90220706,
8.38867657
]
] | agm003522723 | [
[
2.45772413772168,
1.2443648370638074,
4.763321458856839
],
[
-0.0000024577216799604885,
3.618562522936193,
4.138588721143161
],
[
-7.439988400751645e-17,
1.8880435815946057,
7.159487207813399
],
[
2.45771922227832,
6.004646106291627,
3.481664668621009
],
[
2.45772168,
4.257755721970381,
6.5373408750032995
],
[
2.4577241622988963,
-0.5486282247182453,
7.782016119953244
],
[
-5.531427822211299e-17,
0.6051716380296202,
2.3645693049967003
],
[
0.0000024577216801782666,
-1.1417187462916265,
5.42024551137899
],
[
2.45772168,
2.9748837784053936,
1.7424229721866007
],
[
-2.457721682711832e-8,
5.411552682511185,
1.1199024487233256
],
[
2.45772168,
0,
0
]
] | [{"mass": null, "name": "Er", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Er"]}, {"mass": null, "name": "Tm", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Tm"]}, {"mass": null, "name": "Pu", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Pu"]}] | [
"Er",
"Er",
"Tm",
"Tm",
"Tm",
"Tm",
"Tm",
"Tm",
"Tm",
"Tm",
"Pu"
] | 2023-11-16 06:57:59 | [
0.18181818181818182,
0.09090909090909091,
0.7272727272727273
] | [
[
0.48896393,
0,
0
],
[
0,
0.7411689,
0.20209071
],
[
0,
0.20209104,
0.94313574
]
] | -58.742886 | [
-0.081,
-0.081,
0.01,
-0.017,
0.138,
0.111,
0.138,
-0.017,
0.01,
0.111,
5.614
] | [
[
0,
-0.00060553,
0.00182816
],
[
0,
0.00060553,
-0.00182816
],
[
0,
0.00124933,
-0.00037741
],
[
0,
-0.0002285,
0.00151774
],
[
0,
-0.00146034,
-0.00388333
],
[
0,
0.00066977,
-0.00068399
],
[
0,
0.00146034,
0.00388333
],
[
0,
0.0002285,
-0.00151774
],
[
0,
-0.00124933,
0.00037741
],
[
0,
-0.00066977,
0.00068399
],
[
0,
0,
0
]
] | 6.386946 | 20.697971 | pbe | true | 23f0c3f32ea95b46445af75aa9f560e4_12_Er2Tm8Pu1 |
[
"Er",
"Pu",
"Y"
] | 4 | A2BC | ErPu2Y | Y1 Er1 Pu2 | 3 | [
1,
1,
1
] | 3 | [
[
3.43610248,
0,
0
],
[
1.71805124,
2.97575204,
0
],
[
1.71805124,
0.99191735,
11.4002072
]
] | agm001980255 | [
[
0,
0,
0
],
[
3.43610248,
1.983834695,
5.7001036
],
[
5.15415200194876,
2.975751050574874,
8.523548912424209
],
[
1.71805295805124,
0.9919183394251262,
2.8766582875757924
]
] | [{"mass": null, "name": "Er", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Er"]}, {"mass": null, "name": "Pu", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Pu"]}, {"mass": null, "name": "Y", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Y"]}] | [
"Y",
"Er",
"Pu",
"Pu"
] | 2023-11-16 06:57:59 | [
0.25,
0.5,
0.25
] | [
[
3.8689654,
0,
0
],
[
0,
3.8689654,
0
],
[
0,
0,
3.750993
]
] | -38.962156 | [
0.041,
0.119,
5.509,
5.509
] | [
[
0,
0,
0
],
[
0,
0,
0
],
[
0,
0,
0.0047746
],
[
0,
0,
-0.0047746
]
] | 12.000335 | 16.897953 | pbe | true | 4536af599f2cae79319d6b5619e79eb2_166_Y1Er1Pu2 |
[
"Er",
"Pu",
"Y"
] | 4 | A2BC | ErPu2Y | Y1 Er1 Pu2 | 3 | [
1,
1,
1
] | 3 | [
[
5.04679021,
0,
0
],
[
0,
4.80868263,
0
],
[
0,
0,
4.80868263
]
] | agm001247427 | [
[
2.523395105,
2.404341315,
2.404341315
],
[
2.523395105,
0,
0
],
[
0,
0,
2.404341315
],
[
0,
2.404341315,
0
]
] | [{"mass": null, "name": "Er", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Er"]}, {"mass": null, "name": "Pu", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Pu"]}, {"mass": null, "name": "Y", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Y"]}] | [
"Y",
"Er",
"Pu",
"Pu"
] | 2023-11-16 06:57:59 | [
0.25,
0.5,
0.25
] | [
[
3.5435183,
0,
0
],
[
0,
3.839173,
0
],
[
0,
0,
3.839173
]
] | -38.962529 | [
0.195,
0.336,
5.596,
5.596
] | [
[
0,
0,
0
],
[
0,
0,
0
],
[
0,
0,
0
],
[
0,
0,
0
]
] | 12.864758 | 14.587974 | pbe | true | 1842499c447747cad0936b75168afcd7_123_Y1Er1Pu2 |
[
"Er",
"Rh",
"Ru"
] | 11 | A8B2C | Er8Rh2Ru | Er8 Ru1 Rh2 | 3 | [
1,
1,
1
] | 3 | [
[
5.73451003,
0.03118805,
-0.98093017
],
[
-1.93849146,
6.64883069,
-2.92109478
],
[
-0.11641131,
-0.23320954,
7.51196208
]
] | agm006014429 | [
[
2.6631327554315622,
2.2431145373666834,
-0.9187477351179607
],
[
3.1238774984368782,
0.5028706424295724,
1.7194326444446777
],
[
0.2404724661267601,
2.3198752765983692,
1.4882811309607697
],
[
5.174962021521735,
1.2446356654698563,
4.331774618984027
],
[
4.122879969701067,
5.2183746943982925,
-1.692346695344816
],
[
3.3336010534227154,
4.166678408408942,
2.1663039116473968
],
[
0.356082704793888,
5.986721546872553,
1.95116568836399
],
[
0.817405958246829,
4.244292604162417,
4.592658563479678
],
[
0.6440261168279154,
0.017740693803660997,
-0.10077344468619721
],
[
1.4429504723227489,
4.588570495700491,
-0.15640446438053732
],
[
2.141518272992889,
1.950063233769929,
3.843528022100215
]
] | [{"mass": null, "name": "Er", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Er"]}, {"mass": null, "name": "Rh", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Rh"]}, {"mass": null, "name": "Ru", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Ru"]}] | [
"Er",
"Er",
"Er",
"Er",
"Er",
"Er",
"Er",
"Er",
"Ru",
"Rh",
"Rh"
] | 2023-11-16 06:57:59 | [
0.7272727272727273,
0.18181818181818182,
0.09090909090909091
] | [
[
2.0720735,
0.03099327,
0.01293756
],
[
0.0309929,
2.0797179,
0.02798353
],
[
0.01293731,
0.02798347,
2.04529
]
] | -64.872712 | [
0,
0,
0,
0,
0,
0,
0,
0,
0,
0,
0
] | [
[
-0.00066396,
0.00024966,
-0.00147265
],
[
-0.00024611,
-0.00132856,
0.00091991
],
[
0.00499272,
0.00045779,
-0.00056998
],
[
-0.00001777,
-0.0006343,
-0.00146125
],
[
0.0002315,
-0.0015758,
-0.00003394
],
[
-0.00269087,
0.00010375,
0.00053839
],
[
-0.00203768,
0.00222284,
-0.00025534
],
[
-0.00154257,
0.00035281,
0.00257961
],
[
0.00166314,
-0.00091272,
-0.00089252
],
[
0.00029157,
0.00001947,
0.00110126
],
[
0.00002004,
0.00104504,
-0.00045349
]
] | -0.001237 | 9.313097 | pbe | true | c7a5bcc21870a90fa4341fd88538a81d_8_Er8Ru1Rh2 |
[
"Er",
"Rh",
"Si"
] | 4 | A2BC | ErRh2Si | Er1 Si1 Rh2 | 3 | [
1,
1,
1
] | 3 | [
[
4.30908508,
0.00000426,
0.00000299
],
[
2.15454583,
4.06737657,
0.01807883
],
[
2.1545461,
1.76851768,
3.66283179
]
] | agm002356001 | [
[
2.154548453868131,
1.4589845254651503,
0.9202321745637129
],
[
4.309086802091936,
5.835807541262726,
3.680864437845539
],
[
4.309087600190227,
2.918034091091007,
1.8405077668383063
],
[
6.4636431854749485,
4.376911218798091,
2.7606839450835534
]
] | [{"mass": null, "name": "Er", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Er"]}, {"mass": null, "name": "Rh", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Rh"]}, {"mass": null, "name": "Si", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Si"]}] | [
"Si",
"Rh",
"Rh",
"Er"
] | 2023-11-16 06:57:59 | [
0.25,
0.5,
0.25
] | [
[
7.7792144,
0.00236661,
0.00122446
],
[
0.00236604,
7.92055,
0.1779338
],
[
0.00122551,
0.17793448,
7.7489796
]
] | -27.909045 | [
0,
0,
0,
0
] | [
[
0.00002865,
-0.00004111,
0.00002035
],
[
0.00005804,
0.00062959,
0.00038415
],
[
0.00005196,
-0.00073763,
-0.00042638
],
[
-0.00013866,
0.00014914,
0.00002188
]
] | 0 | 0.996899 | pbe | true | 93b26b541660a3fd88587d6f4293a0b9_139_Er1Si1Rh2 |
[
"Er",
"Sb",
"Tm"
] | 11 | A5B4C2 | Er5Sb4Tm2 | Er5 Tm2 Sb4 | 3 | [
1,
1,
1
] | 3 | [
[
3.61455432,
0,
0
],
[
0,
7.04867828,
-1.5258107
],
[
-1.80727716,
-4.70708339,
14.09338563
]
] | agm003363436 | [
[
-1.807277157614397e-8,
5.348046300718822,
1.2103290030008016
],
[
1.8072771780727714,
-3.006451410718823,
11.3572459269992
],
[
1.8072771730743866e-8,
1.8157374592267719,
3.3030717687631364
],
[
1.80727716,
0,
0
],
[
1.8072771419272282,
0.5258574307732281,
9.264503161236863
],
[
1.807275334650068,
2.740040649786871,
6.292460319869923
],
[
0.0000018253499314946675,
-0.39844575978687025,
6.275114610130077
],
[
1.8072789853499316,
4.364956116052264,
3.5866901286114254
],
[
1.8072753346500685,
-0.058246353461906215,
12.23628577528463
],
[
-0.00000182534993165444,
-2.0233612260522653,
8.980884801388576
],
[
0.0000018253499315972862,
2.399841243461906,
0.33128915471537035
]
] | [{"mass": null, "name": "Sb", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Sb"]}, {"mass": null, "name": "Er", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Er"]}, {"mass": null, "name": "Tm", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Tm"]}] | [
"Er",
"Er",
"Er",
"Er",
"Er",
"Tm",
"Tm",
"Sb",
"Sb",
"Sb",
"Sb"
] | 2023-11-16 06:57:59 | [
0.45454545454545453,
0.36363636363636365,
0.18181818181818182
] | [
[
1.2426367,
0,
0
],
[
0,
1.1140159,
0.02069902
],
[
0,
0.02069904,
1.2462409
]
] | -52.827389 | [
0,
0,
0,
0,
0,
0,
0,
0,
0,
0,
0
] | [
[
0,
0.00035312,
0.00023887
],
[
0,
-0.00035312,
-0.00023887
],
[
0,
0.00307939,
0.00267712
],
[
0,
0,
0
],
[
0,
-0.00307939,
-0.00267712
],
[
0,
-0.00160903,
-0.00287702
],
[
0,
0.00160903,
0.00287702
],
[
0,
0.0010498,
-0.00196746
],
[
0,
0.0014548,
0.00073996
],
[
0,
-0.0010498,
0.00196746
],
[
0,
-0.0014548,
-0.00073996
]
] | 0.000157 | 11.19783 | pbe | true | 1d08b213c584ffa28f0fa70a6cdb0a85_12_Er5Tm2Sb4 |
[
"Er",
"Ru",
"Zn"
] | 6 | A3B2C | Er2RuZn3 | Er2 Zn3 Ru1 | 3 | [
1,
1,
1
] | 3 | [
[
4.69717197,
-0.132352,
-2.45767129
],
[
-2.98557132,
4.37620984,
-0.23716505
],
[
-0.16018014,
0.17820356,
5.41150805
]
] | agm005841177 | [
[
2.37137721767615,
1.5509091034150702,
-1.2840613073657376
],
[
-0.81995670767615,
2.8711522965849294,
4.000733017365738
],
[
0.7757102550000001,
2.2110307,
1.358335855
],
[
-0.08009007,
0.08910178,
2.705754025
],
[
2.2684959150000004,
0.022925780000000007,
1.47691838
],
[
0,
0,
0
]
] | [{"mass": null, "name": "Er", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Er"]}, {"mass": null, "name": "Zn", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Zn"]}, {"mass": null, "name": "Ru", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Ru"]}] | [
"Er",
"Er",
"Zn",
"Zn",
"Zn",
"Ru"
] | 2023-11-16 06:57:59 | [
0.3333333333333333,
0.16666666666666666,
0.5
] | [
[
2.9381814,
-0.02152007,
0.09903026
],
[
-0.02151993,
2.829765,
0.14516623
],
[
0.09903047,
0.14516616,
3.0204124
]
] | -24.626822 | [
0,
0,
0,
0,
0,
0
] | [
[
-0.00205044,
0.00268018,
0.00291846
],
[
0.00205044,
-0.00268018,
-0.00291846
],
[
0,
0,
0
],
[
0,
0,
0
],
[
0,
0,
0
],
[
0,
0,
0
]
] | 0.00001 | 3.130987 | pbe | true | 29f78127a6026f0bbf60dc5b8c78d92b_166_Er2Zn3Ru1 |
[
"Er",
"Sc",
"Sn"
] | 4 | A2BC | Er2ScSn | Er2 Sc1 Sn1 | 3 | [
1,
1,
1
] | 3 | [
[
4.67684533,
0,
0
],
[
0,
4.68408553,
0
],
[
0,
0,
4.68408553
]
] | agm001224137 | [
[
2.338422665,
2.342042765,
2.342042765
],
[
2.338422665,
0,
0
],
[
0,
0,
2.342042765
],
[
0,
2.342042765,
0
]
] | [{"mass": null, "name": "Sn", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Sn"]}, {"mass": null, "name": "Er", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Er"]}, {"mass": null, "name": "Sc", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Sc"]}] | [
"Sc",
"Sn",
"Er",
"Er"
] | 2023-11-16 06:57:59 | [
0.5,
0.25,
0.25
] | [
[
2.5995905,
0,
0
],
[
0,
2.3525002,
0
],
[
0,
0,
2.3525002
]
] | -21.048146 | [
0.17,
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0.126,
0.126
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[
0,
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[
0,
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[
0,
0,
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]
] | 0.545923 | 5.140613 | pbe | true | 71dee6b60c49b21bb74fea56c557bbc8_123_Er2Sc1Sn1 |
[
"Er",
"Sc",
"Tb"
] | 11 | A5B3C3 | Er3Sc5Tb3 | Tb3 Er3 Sc5 | 3 | [
1,
1,
1
] | 3 | [
[
5.34945407,
0,
0
],
[
0,
9.03550792,
0
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[
0,
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] | agm003375291 | [
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"Tb",
"Tb",
"Tb",
"Er",
"Er",
"Er",
"Sc",
"Sc",
"Sc",
"Sc",
"Sc"
] | 2023-11-16 06:57:59 | [
0.2727272727272727,
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[
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] | -50.075669 | [
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0.017,
0.017,
0.017,
0.001,
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0.012
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[
0,
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[
0,
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]
] | 0.129857 | 17.784376 | pbe | true | 6c2cc6bca745aa7591beb38c5d370da5_189_Tb3Er3Sc5 |
[
"Er",
"Sc",
"Y"
] | 13 | A8B3C2 | Er3Sc2Y8 | Y8 Er3 Sc2 | 3 | [
1,
1,
1
] | 3 | [
[
5.52543867,
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0.80174549
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[
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[
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] | [{"mass": null, "name": "Er", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Er"]}, {"mass": null, "name": "Sc", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Sc"]}, {"mass": null, "name": "Y", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Y"]}] | [
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"Y",
"Y",
"Y",
"Y",
"Y",
"Y",
"Y",
"Er",
"Er",
"Er",
"Sc",
"Sc"
] | 2023-11-16 06:57:59 | [
0.23076923076923078,
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[
-0.001345,
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]
] | 0.001848 | 19.91883 | pbe | true | 909e58a312881c8a24736a3aa2b50823_65_Y8Er3Sc2 |
[
"Er",
"Se",
"Th"
] | 8 | A4B3C | Er3Se4Th | Er3 Th1 Se4 | 3 | [
1,
1,
1
] | 3 | [
[
4.02705292,
0,
0
],
[
0,
7.10786252,
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[
0,
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]
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"Er",
"Er",
"Er",
"Th",
"Se",
"Se",
"Se",
"Se"
] | 2023-11-16 06:57:59 | [
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0.125
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[
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[
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] | -48.140019 | [
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0,
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[
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]
] | 0.000001 | 4.185003 | pbe | true | 36d00b7596d760fb6abde9dadba08cf1_65_Er3Th1Se4 |
[
"Er",
"Sm",
"Y"
] | 13 | A8B3C2 | Er2Sm8Y3 | Sm8 Y3 Er2 | 3 | [
1,
1,
1
] | 3 | [
[
5.64823954,
0,
0.7921099
],
[
0,
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0
],
[
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] | agm003354394 | [
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] | [{"mass": null, "name": "Er", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Er"]}, {"mass": null, "name": "Sm", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Sm"]}, {"mass": null, "name": "Y", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Y"]}] | [
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"Sm",
"Sm",
"Sm",
"Sm",
"Sm",
"Sm",
"Sm",
"Y",
"Y",
"Y",
"Er",
"Er"
] | 2023-11-16 06:57:59 | [
0.15384615384615385,
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[
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] | -63.504474 | [
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[
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]
] | 0.000003 | 18.930634 | pbe | true | 6f51d0381c5db97900b601e62d1fe572_12_Sm8Y3Er2 |
[
"Er",
"Sm",
"Y"
] | 18 | A5B3C | Er5SmY3 | Sm2 Y6 Er10 | 3 | [
1,
1,
1
] | 3 | [
[
9.3094212,
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1.63775673
],
[
2.5054844,
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[
5.44789931,
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]
] | agm003563350 | [
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] | [{"mass": null, "name": "Er", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Er"]}, {"mass": null, "name": "Sm", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Sm"]}, {"mass": null, "name": "Y", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Y"]}] | [
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"Y",
"Y",
"Er",
"Er",
"Er",
"Er",
"Er",
"Er",
"Er",
"Er",
"Er",
"Er"
] | 2023-11-16 06:57:59 | [
0.5555555555555556,
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] | [
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[
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] | -84.238733 | [
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[
0.00142893,
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]
] | 0.000007 | 24.397743 | pbe | true | f8438df3bd1693c0e4221153aa2a969e_12_Sm2Y6Er10 |
[
"Er",
"Sr",
"Zn"
] | 6 | A4BC | ErSrZn4 | Sr1 Er1 Zn4 | 3 | [
1,
1,
1
] | 3 | [
[
5.59289895,
0,
0
],
[
2.79644947,
4.84359257,
0
],
[
2.79644947,
1.61453086,
4.56658287
]
] | agm001188145 | [
[
2.7964494725000004,
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[
4.179363141999782,
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] | [{"mass": null, "name": "Er", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Er"]}, {"mass": null, "name": "Sr", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Sr"]}, {"mass": null, "name": "Zn", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Zn"]}] | [
"Sr",
"Zn",
"Zn",
"Zn",
"Zn",
"Er"
] | 2023-11-16 06:57:59 | [
0.16666666666666666,
0.16666666666666666,
0.6666666666666666
] | [
[
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0
],
[
0,
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0
],
[
0,
0,
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]
] | -12.50821 | [
0,
0,
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] | [
[
0,
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[
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[
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[
-0.00189831,
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0.00077498
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[
0,
0,
0
]
] | -0.000288 | 4.317956 | pbe | true | aa8b196b5a887c65e37084c23da150e4_216_Sr1Er1Zn4 |
[
"Er",
"Tb",
"Te"
] | 6 | A3B2C | Er2TbTe3 | Tb1 Er2 Te3 | 3 | [
1,
1,
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[
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[
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] | [{"mass": null, "name": "Tb", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Tb"]}, {"mass": null, "name": "Er", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Er"]}, {"mass": null, "name": "Y", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Y"]}] | [
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] | -0.000583 | 24.436972 | pbe | true | ca4ca67424e5532286d4d58aa93ebf0b_148_Tb8Y6Er1 |
[
"Er",
"Tc",
"Tm"
] | 10 | A2B2C | Er2TcTm2 | Er4 Tm4 Tc2 | 3 | [
1,
1,
1
] | 3 | [
[
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0,
0.30391844
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"Er",
"Er",
"Er",
"Er",
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"Tm",
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] | 2023-11-16 06:57:59 | [
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] | 0.000061 | 9.904732 | pbe | true | 9aa49fa25c161e4ec661cced6d28030e_12_Er4Tm4Tc2 |
[
"Er",
"Te",
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] | 13 | A8B4C | ErTe8Th4 | Er1 Th4 Te8 | 3 | [
1,
1,
1
] | 3 | [
[
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0,
0
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] | -0.000117 | 4.489951 | pbe | true | 0799cd499f576637f20b0d14a60b9109_216_Er1Th4Te8 |
[
"Er",
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] | 20 | A6B3C | Er3Te6Zn | Er6 Zn2 Te12 | 3 | [
1,
1,
1
] | 3 | [
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0
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[
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] | [{"mass": null, "name": "Er", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Er"]}, {"mass": null, "name": "Zn", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Zn"]}, {"mass": null, "name": "Te", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Te"]}] | [
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"Te",
"Te",
"Te",
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] | 2023-11-16 06:57:59 | [
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] | 0 | 10.340645 | pbe | true | 6ed2dc91979284976bc7eaca10386aab_36_Er6Zn2Te12 |
[
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"Th",
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] | 10 | A6B3C | Er6ThTm3 | Er6 Tm3 Th1 | 3 | [
1,
1,
1
] | 3 | [
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-2e-7,
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[
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"Er",
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] | 0.000403 | 18.322933 | pbe | true | f25f36e668e819951e0e9e68e96feb7b_155_Er6Tm3Th1 |
[
"Er",
"Th",
"Y"
] | 11 | A7B3C | ErTh3Y7 | Y7 Er1 Th3 | 3 | [
1,
1,
1
] | 3 | [
[
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0,
0
],
[
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] | 2023-11-16 06:57:59 | [
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] | -69.7361 | [
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[
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[
-0.00134594,
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] | -0.000068 | 15.865177 | pbe | true | fbe517a81c4033638d444205fdce52d3_156_Y7Er1Th3 |
[
"Er",
"Tm",
"Y"
] | 6 | A4BC | ErTmY4 | Y4 Er1 Tm1 | 3 | [
1,
1,
1
] | 3 | [
[
3.49826459,
0.76191192,
0.10808432
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[
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[
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"Y",
"Y",
"Y",
"Y",
"Er",
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] | 2023-11-16 06:57:59 | [
0.16666666666666666,
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] | 0.000004 | 8.495574 | pbe | true | d18cfc1a4131697e6adfc9e80fcd1227_12_Y4Er1Tm1 |
[
"Er",
"Tm",
"Y"
] | 14 | A3B2C2 | Er3Tm2Y2 | Y4 Er6 Tm4 | 3 | [
1,
1,
1
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[
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] | [{"mass": null, "name": "Er", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Er"]}, {"mass": null, "name": "Tm", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Tm"]}, {"mass": null, "name": "Y", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Y"]}] | [
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"Er",
"Er",
"Er",
"Er",
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"Tm",
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"Tm"
] | 2023-11-16 06:57:59 | [
0.42857142857142855,
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] | 0.000356 | 18.684334 | pbe | true | 0255f575dc053b8277f7c5275dcee751_199_Y4Er6Tm4 |
[
"Eu",
"Ga",
"Pt"
] | 8 | A2BC | EuGa2Pt | Eu2 Ga4 Pt2 | 3 | [
1,
1,
1
] | 3 | [
[
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0
],
[
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0
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[
0,
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] | agm002213823 | [
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"Eu",
"Eu",
"Ga",
"Ga",
"Ga",
"Ga",
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] | 2023-11-16 06:57:59 | [
0.25,
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0.25
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[
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[
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] | 14.009299 | 6.659644 | pbe | true | 9bdcba456e71023a1506e97390a74e2b_11_Eu2Ga4Pt2 |
[
"Eu",
"H",
"I"
] | 6 | ABC | EuHI | Eu2 H2 I2 | 3 | [
1,
1,
1
] | 3 | [
[
4.18506696,
0,
0
],
[
0,
4.18506696,
0
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[
0,
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] | agm002216382 | [
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] | [{"mass": null, "name": "H", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["H"]}, {"mass": null, "name": "I", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["I"]}, {"mass": null, "name": "Eu", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Eu"]}] | [
"Eu",
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"I",
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] | 2023-11-16 06:57:59 | [
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] | -37.217333 | [
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[
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[
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[
0,
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[
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] | 14.000001 | 0 | pbe | true | e350f2c93788ed62ae3802f3402f270e_129_Eu2H2I2 |
[
"Eu",
"Hg",
"Sc"
] | 4 | A2BC | EuHg2Sc | Eu1 Sc1 Hg2 | 3 | [
1,
1,
1
] | 3 | [
[
3.63702853,
0,
0
],
[
0,
5.28409882,
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[
0,
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] | agm001223542 | [
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[
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[
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] | [{"mass": null, "name": "Hg", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Hg"]}, {"mass": null, "name": "Sc", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Sc"]}, {"mass": null, "name": "Eu", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Eu"]}] | [
"Eu",
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"Hg",
"Hg"
] | 2023-11-16 06:57:59 | [
0.25,
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[
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[
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] | -18.836249 | [
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[
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[
0,
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[
0,
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0
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] | 7.050656 | 7.864688 | pbe | true | fdc3c2c430953c2090193911a483c9ca_123_Eu1Sc1Hg2 |
[
"Eu",
"Ho",
"Pt"
] | 3 | ABC | EuHoPt | Eu1 Ho1 Pt1 | 3 | [
1,
1,
1
] | 3 | [
[
6.43072879,
0,
0
],
[
0,
4.16089215,
0
],
[
0,
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] | agm001261106 | [
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[
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] | [{"mass": null, "name": "Ho", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Ho"]}, {"mass": null, "name": "Pt", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Pt"]}, {"mass": null, "name": "Eu", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Eu"]}] | [
"Eu",
"Ho",
"Pt"
] | 2023-11-16 06:57:59 | [
0.3333333333333333,
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[
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[
0,
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] | -23.093449 | [
6.857,
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0,
0
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[
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0,
0
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[
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0,
0
]
] | 7.296449 | 10.026565 | pbe | true | 9c31d36dd878f634be846e4dd9a99bfd_156_Eu1Ho1Pt1 |
[
"Eu",
"In",
"Th"
] | 4 | A2BC | EuInTh2 | Eu1 Th2 In1 | 3 | [
1,
1,
1
] | 3 | [
[
3.43484821,
0,
0
],
[
1.7174241,
2.97466581,
0
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[
1.7174241,
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] | agm001971051 | [
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[
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] | [{"mass": null, "name": "In", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["In"]}, {"mass": null, "name": "Th", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Th"]}, {"mass": null, "name": "Eu", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Eu"]}] | [
"Eu",
"Th",
"Th",
"In"
] | 2023-11-16 06:57:59 | [
0.25,
0.25,
0.5
] | [
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0,
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[
0,
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[
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] | -27.316818 | [
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[
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[
0,
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[
0,
0,
0
]
] | 7.41298 | 4.40643 | pbe | true | fe87f0237ef43d7d63a3022aac34244f_166_Eu1Th2In1 |
[
"Eu",
"Li",
"S"
] | 3 | ABC | EuLiS | Li1 Eu1 S1 | 3 | [
1,
1,
1
] | 3 | [
[
4.27116808,
0,
0
],
[
0,
4.06771955,
0
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[
0,
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] | agm001413928 | [
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[
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] | [{"mass": null, "name": "S", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["S"]}, {"mass": null, "name": "Li", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Li"]}, {"mass": null, "name": "Eu", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Eu"]}] | [
"Eu",
"S",
"Li"
] | 2023-11-16 06:57:59 | [
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[
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[
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] | -20.136424 | [
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[
0,
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[
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] | 7.956224 | 0.213763 | pbe | true | 8aaafc8b1494f66420e8df9178f9a0ad_187_Li1Eu1S1 |
[
"Eu",
"Li",
"S"
] | 8 | A2BC | EuLiS2 | Li2 Eu2 S4 | 3 | [
1,
1,
1
] | 3 | [
[
3.89351679,
0,
0
],
[
-1.94675839,
3.37188445,
0
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[
0,
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] | agm002284775 | [
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[
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[
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[
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[
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] | [{"mass": null, "name": "S", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["S"]}, {"mass": null, "name": "Li", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Li"]}, {"mass": null, "name": "Eu", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Eu"]}] | [
"Eu",
"Eu",
"S",
"S",
"S",
"S",
"Li",
"Li"
] | 2023-11-16 06:57:59 | [
0.25,
0.25,
0.5
] | [
[
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[
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[
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] | -51.784331 | [
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0,
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[
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0,
-0.001643
],
[
0,
0,
0.001643
],
[
0,
0,
-0.001643
],
[
0,
0,
0.001643
],
[
0,
0,
0
],
[
0,
0,
0
]
] | 12.058841 | 10.578918 | pbe | true | 33bbe097fa60dddfd07e4eec33897fb3_194_Li2Eu2S4 |
[
"Eu",
"Na",
"Pb"
] | 6 | A4BC | EuNaPb4 | Na1 Eu1 Pb4 | 3 | [
1,
1,
1
] | 3 | [
[
6.57924593,
0,
0
],
[
3.28962296,
5.69779411,
0
],
[
3.28962296,
1.8992647,
5.37193181
]
] | agm001180563 | [
[
6.5792492158785345,
3.798527506990865,
0.6625183087932123
],
[
6.5792492158785345,
1.8908040847595002,
3.3604466464249927
],
[
8.23138615987078,
4.752389215595413,
3.3604466464249927
],
[
4.92711226686402,
4.752389215595413,
3.3604466464249927
],
[
0,
0,
0
],
[
3.2896229625,
1.8992647025,
1.3429829525
]
] | [{"mass": null, "name": "Pb", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Pb"]}, {"mass": null, "name": "Na", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Na"]}, {"mass": null, "name": "Eu", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Eu"]}] | [
"Pb",
"Pb",
"Pb",
"Pb",
"Eu",
"Na"
] | 2023-11-16 06:57:59 | [
0.16666666666666666,
0.16666666666666666,
0.6666666666666666
] | [
[
4.602179,
0,
0
],
[
0,
4.602179,
0
],
[
0,
0,
4.602179
]
] | -27.571813 | [
-0.007,
-0.007,
-0.007,
-0.007,
-6.904,
0
] | [
[
0,
0,
0.00450416
],
[
0,
0.00424656,
-0.00150139
],
[
-0.00367763,
-0.00212328,
-0.00150139
],
[
0.00367763,
-0.00212328,
-0.00150139
],
[
0,
0,
0
],
[
0,
0,
0
]
] | -7.234572 | 19.142197 | pbe | true | d2e81706f66ff0b0934a77194235ff1a_216_Na1Eu1Pb4 |