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[ "In", "Ru", "Sm" ]
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InRuSm2
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agm005657611
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2023-11-16 06:57:59
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2023-11-16 06:57:59
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2023-11-16 06:57:59
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2023-11-16 06:57:59
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4c078ccb11790b8911068b1ce8a6ec6a_123_Tb1In2Ru1
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[ "In", "In", "Ru", "Te" ]
2023-11-16 06:57:59
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51944f11fa6b890c96d6233be9bb756a_6_In2Te1Ru1
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In2S4Sr
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2023-11-16 06:57:59
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A2B2C
InS2Tl2
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[ "Tl", "Tl", "S", "S", "In" ]
2023-11-16 06:57:59
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2023-11-16 06:57:59
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2023-11-16 06:57:59
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2023-11-16 06:57:59
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2023-11-16 06:57:59
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2023-11-16 06:57:59
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2023-11-16 06:57:59
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2023-11-16 06:57:59
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[ "Te", "Zr", "Zr", "Zr", "In" ]
2023-11-16 06:57:59
[ 0.2, 0.2, 0.6 ]
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7.855386
pbe
true
58f9ccd08dd61d3e765ce5bb1e493b39_221_Zr3In1Te1
[ "In", "Tl", "Tm" ]
10
A3BC
InTlTm3
Tm6 Tl2 In2
3
[ 1, 1, 1 ]
3
[ [ 4.8422074, 0, 1.1065648 ], [ 0, 4.96526893, 0 ], [ -0.02343636, 0, 11.25032425 ] ]
agm005817702
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[ "Tm", "Tm", "Tm", "Tm", "Tm", "Tm", "Tl", "Tl", "In", "In" ]
2023-11-16 06:57:59
[ 0.2, 0.2, 0.6 ]
[ [ 1.9624097, 0, -0.04621763 ], [ 0, 2.152474, 0 ], [ -0.04621763, 0, 2.1540911 ] ]
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0.258918
7.814728
pbe
true
989de98e32c90969b6e7592464abd294_63_Tm6Tl2In2
[ "In", "Tl", "Zr" ]
4
A2BC
In2TlZr
Zr1 Tl1 In2
3
[ 1, 1, 1 ]
3
[ [ 3.29349125, -0.0545448, 0 ], [ -1.35369744, 3.00292574, 0 ], [ 0, 0, 10.41349803 ] ]
agm004280892
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[ "In", "In", "Tl", "Zr" ]
2023-11-16 06:57:59
[ 0.5, 0.25, 0.25 ]
[ [ 4.5084434, 0.18566631, 0 ], [ 0.18566631, 4.668493, 0 ], [ 0, 0, 4.652584 ] ]
-16.084147
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[ [ 0, 0, -0.00496792 ], [ 0, 0, -0.00192227 ], [ 0, 0, 0.00778327 ], [ 0, 0, -0.00089309 ] ]
0.000004
3.516
pbe
true
15e3058454c850531c2ed76b3f2f7fd6_35_Zr1Tl1In2
[ "In", "Tm", "Zr" ]
4
A2BC
InTm2Zr
Tm2 Zr1 In1
3
[ 1, 1, 1 ]
3
[ [ 5.22411172, 0, 0 ], [ 2.61205586, 4.52421347, 0 ], [ 2.61205586, 1.50807116, 4.26615967 ] ]
agm005125793
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[ "Tm", "Tm", "Zr", "In" ]
2023-11-16 06:57:59
[ 0.25, 0.5, 0.25 ]
[ [ 2.4616842, 0, 0 ], [ 0, 2.4616842, 0 ], [ 0, 0, 2.3064198 ] ]
-20.405725
[ 0.068, 0.114, 0.159, -0.002 ]
[ [ 0, 0, -0.0004878 ], [ 0, 0, -0.00031981 ], [ 0, 0, -0.00021849 ], [ 0, 0, 0.0010261 ] ]
0.461067
7.656603
pbe
true
cff73116e70fc0206f5f091064596740_216_Tm2Zr1In1
[ "Ir", "K", "Mn" ]
4
A2BC
Ir2KMn
K1 Mn1 Ir2
3
[ 1, 1, 1 ]
3
[ [ 5.38506789, 0, 0 ], [ 0, 5.38506789, 0 ], [ 0, 0, 2.54717672 ] ]
agm004334494
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[{"mass": null, "name": "Mn", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Mn"]}, {"mass": null, "name": "K", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["K"]}, {"mass": null, "name": "Ir", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Ir"]}]
[ "Ir", "Ir", "K", "Mn" ]
2023-11-16 06:57:59
[ 0.5, 0.25, 0.25 ]
[ [ 2.796957, 0, 0 ], [ 0, 2.796957, 0 ], [ 0, 0, 2.6682985 ] ]
-23.763723
[ -0.001, -0.001, -0.006, 3.665 ]
[ [ 0, 0, 0 ], [ 0, 0, 0 ], [ 0, 0, 0 ], [ 0, 0, 0 ] ]
3.879433
3.571799
pbe
true
e3eaf912550c12a46f0ddf8fcbe74f53_123_K1Mn1Ir2
[ "Ir", "K", "Os" ]
6
ABC
IrKOs
K2 Ir2 Os2
3
[ 1, 1, 1 ]
3
[ [ 4.88116128, 0.00153843, 0.02241699 ], [ -1.96392424, 4.47314858, -0.0231114 ], [ 1.90058203, 0.45502466, 6.34612472 ] ]
agm003085808
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[{"mass": null, "name": "K", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["K"]}, {"mass": null, "name": "Os", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Os"]}, {"mass": null, "name": "Ir", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Ir"]}]
[ "K", "K", "Ir", "Ir", "Os", "Os" ]
2023-11-16 06:57:59
[ 0.3333333333333333, 0.3333333333333333, 0.3333333333333333 ]
[ [ 3.3769615, 1.133059, 0.14845325 ], [ 1.1330594, 4.81271, -0.14613777 ], [ 0.14845407, -0.1461379, 4.993581 ] ]
-39.160176
[ 0, 0, 0, 0, 0, 0 ]
[ [ 0.00022451, -0.0005764, 0.00090864 ], [ -0.00283183, 0.00104271, 0.00719578 ], [ 0.00391724, -0.00097333, 0.0391329 ], [ 0.0011844, -0.00367043, 0.03956978 ], [ -0.00471823, 0.0017976, -0.0463834 ], [ 0.00222391, 0.00237985, -0.04042369 ] ]
0
5.077991
pbe
true
7d0e6bd5577f83ce4e9d7a6c4c6b4086_1_K2Ir2Os2
[ "Ir", "K", "Re" ]
4
A2BC
IrKRe2
K1 Re2 Ir1
3
[ 1, 1, 1 ]
3
[ [ 10.65017994, -0.01390867, -0.00812121 ], [ 10.2904598, 2.74462444, -0.00812121 ], [ 10.2904598, 1.34190365, 2.3942272 ] ]
agm003812218
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[{"mass": null, "name": "Re", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Re"]}, {"mass": null, "name": "K", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["K"]}, {"mass": null, "name": "Ir", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Ir"]}]
[ "Ir", "K", "Re", "Re" ]
2023-11-16 06:57:59
[ 0.25, 0.25, 0.5 ]
[ [ 8.57687, 0.04783112, 0.02792838 ], [ 0.04783112, 8.216311, 0.00364194 ], [ 0.02792838, 0.00364194, 8.2122 ] ]
-31.969763
[ 0, 0, 0, 0 ]
[ [ 0, 0, 0 ], [ 0, 0, 0 ], [ 0.00192174, 0.0002506, 0.00014632 ], [ -0.00192174, -0.0002506, -0.00014632 ] ]
0.000002
2.989299
pbe
true
0773ed409504ab067115d716bb2b87f8_166_K1Re2Ir1
[ "Ir", "K", "Se" ]
8
A4B3C
IrK3Se4
K3 Ir1 Se4
3
[ 1, 1, 1 ]
3
[ [ 11.73612188, 0.00115329, 0 ], [ -0.00040446, 4.26887813, 0 ], [ 0, 0, 19.18967363 ] ]
agm2000078212
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[{"mass": null, "name": "Se", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Se"]}, {"mass": null, "name": "K", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["K"]}, {"mass": null, "name": "Ir", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Ir"]}]
[ "K", "K", "K", "Ir", "Se", "Se", "Se", "Se" ]
2023-11-16 06:57:59
[ 0.125, 0.375, 0.5 ]
[ [ 0.3135481, -0.00006009, -0.00017734 ], [ -0.0000601, 0.28819513, -0.00271914 ], [ -0.00017733, -0.00271918, -0.13163856 ] ]
-29.933914
[ 0.002, 0.002, 0, -0.001, -0.002, -0.002, 0.436, 0.006 ]
[ [ -0.0007949, -0.00027133, -0.00115033 ], [ 0.00102398, -0.0003206, -0.00142969 ], [ -0.00008055, -0.00026616, 0.00158953 ], [ -0.00007841, 0.00016684, -0.00341848 ], [ 0.00114997, 0.0005214, 0.00104003 ], [ -0.00104033, 0.00051175, 0.00102719 ], [ -0.00008127, -0.00068021, -0.0034878 ], [ -0.00009848, 0.0003383, 0.00582956 ] ]
0.794197
6.418726
pbe
true
3fc1988cab69896a3af06d8f0c9feefd_25_K3Ir1Se4
[ "Ir", "K", "Se" ]
12
A3B2C
Ir2KSe3
K2 Ir4 Se6
3
[ 1, 1, 1 ]
3
[ [ 7.32473554, 0, 0 ], [ 3.66236777, 6.34340706, 0 ], [ 3.66236777, 2.11446901, 6.72107152 ] ]
agm002155858
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[{"mass": null, "name": "Se", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Se"]}, {"mass": null, "name": "K", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["K"]}, {"mass": null, "name": "Ir", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Ir"]}]
[ "K", "K", "Ir", "Ir", "Ir", "Ir", "Se", "Se", "Se", "Se", "Se", "Se" ]
2023-11-16 06:57:59
[ 0.3333333333333333, 0.16666666666666666, 0.5 ]
[ [ 2.174529, 0, 0 ], [ 0, 2.174529, 0 ], [ 0, 0, 1.2466583 ] ]
-61.6824
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2.932337
14.520886
pbe
true
ea506f83fcdf71eb996f104095341eb3_166_K2Ir4Se6
[ "Ir", "K", "Sn" ]
5
A2B2C
Ir2KSn2
K1 Sn2 Ir2
3
[ 1, 1, 1 ]
3
[ [ 4.67731448, 0, 0 ], [ 0, 4.67731448, 0 ], [ 2.33865724, 2.33865724, 5.27595291 ] ]
agm002927981
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[{"mass": null, "name": "Sn", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Sn"]}, {"mass": null, "name": "K", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["K"]}, {"mass": null, "name": "Ir", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Ir"]}]
[ "K", "Ir", "Ir", "Sn", "Sn" ]
2023-11-16 06:57:59
[ 0.4, 0.2, 0.4 ]
[ [ 4.3466763, 0, 0 ], [ 0, 4.3466763, 0 ], [ 0, 0, 4.7011147 ] ]
-27.179096
[ 0, 0, 0, 0, 0 ]
[ [ 0, 0, 0 ], [ 0, 0, 0.00116276 ], [ 0, 0, -0.00116276 ], [ 0, 0, 0 ], [ 0, 0, 0 ] ]
-0.000011
2.75079
pbe
true
cee31eba74d8a20e079a2282661d912a_139_K1Sn2Ir2
[ "Ir", "K", "Ta" ]
4
A2BC
Ir2KTa
K1 Ta1 Ir2
3
[ 1, 1, 1 ]
3
[ [ 3.1021794, 0, 0 ], [ 0, 3.13873953, -0.00082288 ], [ 0, 3.16293194, 8.37045168 ] ]
agm004291385
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[{"mass": null, "name": "Ta", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Ta"]}, {"mass": null, "name": "K", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["K"]}, {"mass": null, "name": "Ir", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Ir"]}]
[ "Ir", "Ir", "K", "Ta" ]
2023-11-16 06:57:59
[ 0.5, 0.25, 0.25 ]
[ [ 3.89294, 0, 0 ], [ 0, 3.7026792, -0.0169926 ], [ 0, -0.0169927, 3.8984227 ] ]
-30.814394
[ 0, 0, 0, 0 ]
[ [ 0, -0.00039271, 0.00477577 ], [ 0, 0.00039271, -0.00477577 ], [ 0, 0, 0 ], [ 0, 0, 0 ] ]
-0
2.594634
pbe
true
36fab31b9b436b60bfce6c238afa0fce_47_K1Ta1Ir2
[ "Ir", "La", "Mg" ]
4
A2BC
IrLaMg2
La1 Mg2 Ir1
3
[ 1, 1, 1 ]
3
[ [ 3.25600815, 0.0038809, 0 ], [ -0.00190988, 3.2560099, 0 ], [ 0, 0, 8.2580261 ] ]
agm004249370
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[{"mass": null, "name": "La", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["La"]}, {"mass": null, "name": "Mg", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Mg"]}, {"mass": null, "name": "Ir", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Ir"]}]
[ "Ir", "La", "Mg", "Mg" ]
2023-11-16 06:57:59
[ 0.25, 0.25, 0.5 ]
[ [ 1.2961148, -0.333556, 0 ], [ -0.333556, 1.2949283, 0 ], [ 0, 0, 1.2684278 ] ]
-17.810138
[ 0, 0, 0, 0 ]
[ [ 0, 0, 0 ], [ 0, 0, 0 ], [ 0, 0, 0.00105721 ], [ 0, 0, -0.00105721 ] ]
-0.000003
1.792831
pbe
true
90fd7034e3896282bb96680941ea857c_123_La1Mg2Ir1
[ "Ir", "La", "Na" ]
10
A3BC
IrLa3Na
Na2 La6 Ir2
3
[ 1, 1, 1 ]
3
[ [ 6.35564844, 0, 0 ], [ 0, 6.35564844, 0 ], [ 3.17782422, 3.17782422, 9.49288885 ] ]
agm003113223
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[{"mass": null, "name": "La", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["La"]}, {"mass": null, "name": "Na", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Na"]}, {"mass": null, "name": "Ir", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Ir"]}]
[ "Na", "Na", "Ir", "Ir", "La", "La", "La", "La", "La", "La" ]
2023-11-16 06:57:59
[ 0.2, 0.6, 0.2 ]
[ [ 1.1410499, 0, 0 ], [ 0, 1.1410499, 0 ], [ 0, 0, 0.739833 ] ]
-48.909016
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-0
8.220174
pbe
true
bf5812af7478dbf2cf0282c60e3c75f7_119_Na2La6Ir2
[ "Ir", "La", "Os" ]
4
A2BC
Ir2LaOs
La1 Ir2 Os1
3
[ 1, 1, 1 ]
3
[ [ 5.00834464, -0.0006621, -0.0023286 ], [ -1.54883364, 4.76283853, -0.0023286 ], [ 0.0021215, 0.00292034, 2.9232112 ] ]
agm003978313
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[{"mass": null, "name": "La", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["La"]}, {"mass": null, "name": "Os", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Os"]}, {"mass": null, "name": "Ir", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Ir"]}]
[ "Ir", "Ir", "La", "Os" ]
2023-11-16 06:57:59
[ 0.5, 0.25, 0.25 ]
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0.000027
3.351262
pbe
true
830339957dc8065b4710cb69a0d0aefe_65_La1Ir2Os1
[ "Ir", "La", "W" ]
4
A2BC
IrLa2W
La2 Ir1 W1
3
[ 1, 1, 1 ]
3
[ [ 8.69936045, -0.26460342, -0.1564053 ], [ 8.00308488, 3.42045604, -0.1564053 ], [ 8.00308488, 1.51214723, 3.072034 ] ]
agm004154274
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[ "Ir", "La", "La", "W" ]
2023-11-16 06:57:59
[ 0.25, 0.5, 0.25 ]
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-29.49805
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1.618602
2.771124
pbe
true
6cdd3d8bda92e78dc3faef993b469d72_166_La2Ir1W1
[ "Ir", "Li", "Pa" ]
4
A2BC
Ir2LiPa
Li1 Pa1 Ir2
3
[ 1, 1, 1 ]
3
[ [ 4.63863222, 0, 0 ], [ 2.31931611, 4.01717335, 0 ], [ 2.31931611, 1.33905778, 3.78742735 ] ]
agm001093027
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[{"mass": null, "name": "Li", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Li"]}, {"mass": null, "name": "Pa", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Pa"]}, {"mass": null, "name": "Ir", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Ir"]}]
[ "Pa", "Li", "Ir", "Ir" ]
2023-11-16 06:57:59
[ 0.5, 0.25, 0.25 ]
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-31.331906
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[ [ 0, 0, 0 ], [ 0, 0, 0 ], [ 0, 0, 0 ], [ 0, 0, 0 ] ]
-0.000012
3.611668
pbe
true
64d14c2c217c16585eb462808bbbdfb8_225_Li1Pa1Ir2
[ "Ir", "Nb", "Rh" ]
12
A3B2C
IrNb2Rh3
Nb4 Ir2 Rh6
3
[ 1, 1, 1 ]
3
[ [ 7.88885143, 0, 0 ], [ 0, 5.41093622, 0 ], [ -3.94442571, -2.70546811, 5.07585874 ] ]
agm003423145
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[{"mass": null, "name": "Nb", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Nb"]}, {"mass": null, "name": "Rh", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Rh"]}, {"mass": null, "name": "Ir", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Ir"]}]
[ "Nb", "Nb", "Nb", "Nb", "Ir", "Ir", "Rh", "Rh", "Rh", "Rh", "Rh", "Rh" ]
2023-11-16 06:57:59
[ 0.16666666666666666, 0.3333333333333333, 0.5 ]
[ [ 8.399326, 0, 0 ], [ 0, 7.8582873, 0 ], [ 0, 0, 7.949609 ] ]
-101.819676
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0.00001
8.796575
pbe
true
ee595893f740481ec9ffce45bc54f538_72_Nb4Ir2Rh6
[ "Ir", "Li", "Pt" ]
4
A2BC
Ir2LiPt
Li1 Ir2 Pt1
3
[ 1, 1, 1 ]
3
[ [ 4.70737683, -0.00468434, 0 ], [ 1.62864629, 4.41666501, 0 ], [ -3.16801055, -2.20598963, 2.69383322 ] ]
agm004441567
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[{"mass": null, "name": "Li", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Li"]}, {"mass": null, "name": "Ir", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Ir"]}, {"mass": null, "name": "Pt", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Pt"]}]
[ "Ir", "Ir", "Li", "Pt" ]
2023-11-16 06:57:59
[ 0.5, 0.25, 0.25 ]
[ [ 4.1367354, -0.4117752, 0.00000176 ], [ -0.4117752, 4.441351, 0.00000123 ], [ 0.00000176, 0.00000123, 4.72809 ] ]
-26.079482
[ 0, 0, 0, 0 ]
[ [ 0, 0, 0 ], [ 0, 0, 0 ], [ 0, 0, 0 ], [ 0, 0, 0 ] ]
-0.000007
2.885884
pbe
true
2c6f5447621ce227919a577b5f790b71_139_Li1Ir2Pt1
[ "Ir", "Li", "Rh" ]
14
A3B3C
Ir3LiRh3
Li2 Ir6 Rh6
3
[ 1, 1, 1 ]
3
[ [ 4.39240587, 0, 0 ], [ 0, 6.20711442, -3.5836195 ], [ 0, -0.00005134, 7.16732827 ] ]
agm005884515
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[{"mass": null, "name": "Rh", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Rh"]}, {"mass": null, "name": "Li", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Li"]}, {"mass": null, "name": "Ir", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Ir"]}]
[ "Li", "Li", "Ir", "Ir", "Ir", "Ir", "Ir", "Ir", "Rh", "Rh", "Rh", "Rh", "Rh", "Rh" ]
2023-11-16 06:57:59
[ 0.42857142857142855, 0.14285714285714285, 0.42857142857142855 ]
[ [ 8.4081135, 0, 0 ], [ 0, 9.055242, 0.00000274 ], [ 0, -0.00000221, 9.05524 ] ]
-101.352346
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-0
16.08169
pbe
true
a1cf1b351ef9a3295b615e94c0a5e738_176_Li2Ir6Rh6
[ "Ir", "Li", "Ru" ]
6
ABC
IrLiRu
Li2 Ru2 Ir2
3
[ 1, 1, 1 ]
3
[ [ 14.09198005, 0, -0.03815122 ], [ 3.85270036, 2.31580505, -1.24966962 ], [ -3.85270036, 2.31580505, 1.24966962 ] ]
agm003094857
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[{"mass": null, "name": "Li", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Li"]}, {"mass": null, "name": "Ru", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Ru"]}, {"mass": null, "name": "Ir", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Ir"]}]
[ "Ru", "Ru", "Ir", "Ir", "Li", "Li" ]
2023-11-16 06:57:59
[ 0.3333333333333333, 0.3333333333333333, 0.3333333333333333 ]
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-39.838506
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0.000213
6.898513
pbe
true
3aab2f8d7f83a817cbc7d4dffe8154b5_5_Li2Ru2Ir2
[ "Ir", "Li", "W" ]
5
A3BC
IrLi3W
Li3 Ir1 W1
3
[ 1, 1, 1 ]
3
[ [ 4.42334224, 0, 0 ], [ 0, 4.42334224, 0 ], [ 0, 0, 4.42334224 ] ]
agm002513484
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[{"mass": null, "name": "W", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["W"]}, {"mass": null, "name": "Li", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Li"]}, {"mass": null, "name": "Ir", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Ir"]}]
[ "Ir", "W", "Li", "Li", "Li" ]
2023-11-16 06:57:59
[ 0.2, 0.6, 0.2 ]
[ [ -1.6358458, 0, 0 ], [ 0, -1.6358458, 0 ], [ 0, 0, -1.6358458 ] ]
-16.46831
[ 0, 0, 0, 0, 0 ]
[ [ 0, 0, 0 ], [ 0, 0, 0 ], [ 0, 0, 0 ], [ 0, 0, 0 ], [ 0, 0, 0 ] ]
0.000005
10.30737
pbe
true
ed7dbe6b3ced48c407e3d2a4ef6ed8e4_221_Li3Ir1W1
[ "Ir", "Li", "Zn" ]
18
A4B3C2
Ir3Li4Zn2
Li8 Zn4 Ir6
3
[ 1, 1, 1 ]
3
[ [ 5.11289989, -0.00010317, 0.00033916 ], [ 0.00014215, 6.39689882, 3.69506008 ], [ -0.00023198, 0.00925286, 7.3874026 ] ]
agm005671668
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[{"mass": null, "name": "Li", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Li"]}, {"mass": null, "name": "Ir", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Ir"]}, {"mass": null, "name": "Zn", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Zn"]}]
[ "Li", "Li", "Li", "Li", "Li", "Li", "Li", "Li", "Zn", "Zn", "Zn", "Zn", "Ir", "Ir", "Ir", "Ir", "Ir", "Ir" ]
2023-11-16 06:57:59
[ 0.3333333333333333, 0.4444444444444444, 0.2222222222222222 ]
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-77.004285
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-0.000001
6.427576
pbe
true
646e989bf90fae0bae3f481e463d81b4_66_Li8Zn4Ir6
[ "Ir", "Mg", "Rb" ]
5
A3BC
Ir3MgRb
Rb1 Mg1 Ir3
3
[ 1, 1, 1 ]
3
[ [ 4.86939135, 0, 0 ], [ 0, 4.86939135, 0 ], [ 0, 0, 4.86939135 ] ]
agm002523249
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[{"mass": null, "name": "Rb", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Rb"]}, {"mass": null, "name": "Mg", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Mg"]}, {"mass": null, "name": "Ir", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Ir"]}]
[ "Mg", "Ir", "Ir", "Ir", "Rb" ]
2023-11-16 06:57:59
[ 0.6, 0.2, 0.2 ]
[ [ 4.167846, 0, 0 ], [ 0, 4.167846, 0 ], [ 0, 0, 4.167846 ] ]
-15.024784
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1.107544
6.124987
pbe
true
73363d6a2495042dfe9876d477a2cbbd_221_Rb1Mg1Ir3
[ "Ir", "Mg", "Tc" ]
6
ABC
IrMgTc
Mg2 Tc2 Ir2
3
[ 1, 1, 1 ]
3
[ [ 2.83946877, -0.00195067, 0.00339346 ], [ -1.39259521, 4.97573407, 0.00748638 ], [ 1.39522104, -0.92910549, 6.69969079 ] ]
agm003101906
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[{"mass": null, "name": "Tc", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Tc"]}, {"mass": null, "name": "Mg", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Mg"]}, {"mass": null, "name": "Ir", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Ir"]}]
[ "Mg", "Mg", "Ir", "Ir", "Tc", "Tc" ]
2023-11-16 06:57:59
[ 0.3333333333333333, 0.3333333333333333, 0.3333333333333333 ]
[ [ 2.6974137, -0.06036349, -0.0129109 ], [ -0.06036229, -0.61130404, 1.0049697 ], [ -0.01291003, 1.0049695, -2.044794 ] ]
-41.81385
[ 0, 0, 0, 0, 0, 0 ]
[ [ 0.00478466, -0.00430303, 0.00453757 ], [ -0.00343954, -0.00011003, -0.0064065 ], [ 0.00596166, 0.00399563, 0.02946022 ], [ -0.00656212, 0.0037092, -0.01936096 ], [ 0.00324776, 0.00986091, 0.00921047 ], [ -0.00399243, -0.01315268, -0.0174408 ] ]
0
3.504429
pbe
true
4d09352b548dab9a037b6cb19c42667a_1_Mg2Tc2Ir2
[ "Ir", "Mg", "Y" ]
11
A4B4C3
Ir4Mg4Y3
Y3 Mg4 Ir4
3
[ 1, 1, 1 ]
3
[ [ 3.86931704, -1e-8, -0.96250163 ], [ -0.94942193, 6.75819885, -3.81673481 ], [ 0.04142201, 0.24046294, 8.42521799 ] ]
agm005700353
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[{"mass": null, "name": "Mg", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Mg"]}, {"mass": null, "name": "Ir", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Ir"]}, {"mass": null, "name": "Y", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Y"]}]
[ "Y", "Y", "Y", "Mg", "Mg", "Mg", "Mg", "Ir", "Ir", "Ir", "Ir" ]
2023-11-16 06:57:59
[ 0.36363636363636365, 0.36363636363636365, 0.2727272727272727 ]
[ [ 1.1001673, 0.00535205, 0.0081677 ], [ 0.00535205, 1.1078079, 0.02151568 ], [ 0.0081677, 0.02151568, 1.1309701 ] ]
-66.907576
[ 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0 ]
[ [ -0.00098008, -0.00236281, -0.00393998 ], [ 0.00098008, 0.00236281, 0.00393998 ], [ 0, 0, 0 ], [ 0.00093073, 0.01270696, 0.00374158 ], [ -0.00312677, 0.00292498, -0.01256981 ], [ -0.00093073, -0.01270696, -0.00374158 ], [ 0.00312677, -0.00292498, 0.01256981 ], [ -0.00003334, -0.00008039, -0.00013405 ], [ 0.00003334, 0.00008039, 0.00013405 ], [ -0.00065827, 0.0046857, -0.00264628 ], [ 0.00065827, -0.0046857, 0.00264628 ] ]
0
3.976885
pbe
true
0f6aa9277f8ef9984512ac2f2df288da_71_Y3Mg4Ir4
[ "Ir", "Mn", "Rh" ]
6
A4BC
IrMnRh4
Mn1 Ir1 Rh4
3
[ 1, 1, 1 ]
3
[ [ 3.93272121, 0, 0 ], [ 1.96636061, 3.42246542, 0.17278297 ], [ 1.9663606, 0.76216064, 7.25673854 ] ]
agm003749591
[ [ 3.93272121, 2.09231303, 3.714760755 ], [ 0, 0, 0 ], [ 3.93272119259344, 2.216195079593005, 1.2697769732844468 ], [ 3.9327212274065593, 1.9684309804069944, 6.159744536715553 ], [ 1.966360602476057, 0.8999509968191449, 4.577859035859392 ], [ 5.899081817523943, 3.284675063180855, 2.8516624741406074 ] ]
[{"mass": null, "name": "Mn", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Mn"]}, {"mass": null, "name": "Rh", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Rh"]}, {"mass": null, "name": "Ir", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Ir"]}]
[ "Mn", "Ir", "Rh", "Rh", "Rh", "Rh" ]
2023-11-16 06:57:59
[ 0.16666666666666666, 0.16666666666666666, 0.6666666666666666 ]
[ [ 11.094678, 3e-8, 0 ], [ 3e-8, 11.241555, -0.07144857 ], [ 0, -0.07144872, 11.128295 ] ]
-45.092391
[ 2.379, -0.165, -0.169, -0.169, -0.009, -0.009 ]
[ [ 0, 0, 0 ], [ 0, 0, 0 ], [ 0, 0.00226289, 0.00799558 ], [ 0, -0.00226289, -0.00799558 ], [ 0, -0.00246723, 0.01248373 ], [ 0, 0.00246723, -0.01248373 ] ]
1.893098
6.746124
pbe
true
235c937f64a47ae5dc00fec4473fe0e7_12_Mn1Ir1Rh4
[ "Ir", "Mn", "Ru" ]
8
A4B3C
Ir4MnRu3
Mn1 Ru3 Ir4
3
[ 1, 1, 1 ]
3
[ [ 2.66944516, 0, -0.58760177 ], [ -0.05837483, 3.96617314, -0.26519554 ], [ 1.03458297, -0.45711061, 11.05744192 ] ]
agm006091179
[ [ -0.029187415, 1.98308657, -0.13259777 ], [ 0.7311064641810425, 0.6304483131416618, 3.321381236408977 ], [ 2.9145468358189577, 2.878614216858338, 6.883263373591024 ], [ 1.33472258, 0, -0.293800885 ], [ 1.8753709751126642, 0.9839417053409523, 8.519719533802112 ], [ 1.7702823248873358, 2.525120824659047, 1.6849250761978878 ], [ 2.3357465880982233, 2.6976144915737477, 4.253795533638418 ], [ 1.3099067119017767, 0.8114480384262527, 5.950849076361583 ] ]
[{"mass": null, "name": "Mn", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Mn"]}, {"mass": null, "name": "Ru", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Ru"]}, {"mass": null, "name": "Ir", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Ir"]}]
[ "Ru", "Ru", "Ru", "Mn", "Ir", "Ir", "Ir", "Ir" ]
2023-11-16 06:57:59
[ 0.5, 0.125, 0.375 ]
[ [ 5.667373, 0.01597296, -0.01595913 ], [ 0.01597285, 5.558748, 0.07256169 ], [ -0.01595913, 0.07256222, 5.5983877 ] ]
-70.511432
[ -0.041, -0.048, -0.048, 2.879, -0.052, -0.052, -0.014, -0.014 ]
[ [ 0, 0, 0 ], [ -0.00058107, -0.00251578, -0.00263979 ], [ 0.00058107, 0.00251578, 0.00263979 ], [ 0, 0, 0 ], [ -0.00019316, -0.00029632, -0.00087752 ], [ 0.00019316, 0.00029632, 0.00087752 ], [ 0.00019153, 0.0037629, 0.00087009 ], [ -0.00019153, -0.0037629, -0.00087009 ] ]
2.737278
8.202166
pbe
true
f6d333a933a9e58096b04eff08287562_12_Mn1Ru3Ir4
[ "Ir", "Mn", "V" ]
4
A2BC
IrMnV2
Mn1 V2 Ir1
3
[ 1, 1, 1 ]
3
[ [ 4.2137137, 0, 0 ], [ 2.10685685, 3.64918311, 0 ], [ 2.10685685, 1.21639437, 3.44048283 ] ]
agm001100088
[ [ 4.2137137, 2.43278874, 1.720241415 ], [ 0, 0, 0 ], [ 2.10685685, 1.21639437, 0.8601207075 ], [ 6.320570549999999, 3.64918311, 2.5803621225 ] ]
[{"mass": null, "name": "Mn", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Mn"]}, {"mass": null, "name": "Ir", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Ir"]}, {"mass": null, "name": "V", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["V"]}]
[ "Ir", "Mn", "V", "V" ]
2023-11-16 06:57:59
[ 0.25, 0.25, 0.5 ]
[ [ 5.305019, 0, 0 ], [ 0, 5.305019, 0 ], [ 0, 0, 5.305019 ] ]
-37.279251
[ 0.008, -1.363, 0.732, 0.732 ]
[ [ 0, 0, 0 ], [ 0, 0, 0 ], [ 0, 0, 0 ], [ 0, 0, 0 ] ]
0.240724
5.675943
pbe
true
3783752ea65c041ee39f36774f302b91_225_Mn1V2Ir1
[ "Ir", "Mo", "Rh" ]
4
A2BC
IrMo2Rh
Mo2 Ir1 Rh1
3
[ 1, 1, 1 ]
3
[ [ 4.78090068, 0.00370551, 0.01681859 ], [ 3.97791933, 2.65201487, 0.01681859 ], [ 0.77859819, 0.23607507, 4.76881511 ] ]
agm004245132
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[{"mass": null, "name": "Mo", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Mo"]}, {"mass": null, "name": "Rh", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Rh"]}, {"mass": null, "name": "Ir", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Ir"]}]
[ "Ir", "Mo", "Mo", "Rh" ]
2023-11-16 06:57:59
[ 0.25, 0.5, 0.25 ]
[ [ 8.147067, 0.13979287, 0.10120624 ], [ 0.13979287, 7.7284026, 0.03068627 ], [ 0.10120618, 0.03068625, 7.6471767 ] ]
-38.476757
[ 0, 0, 0, 0 ]
[ [ -0.00080974, -0.00024552, 0.00100629 ], [ 0.00335191, 0.00101632, 0.00178161 ], [ -0.00198676, -0.00060239, -0.00013767 ], [ -0.00055541, -0.0001684, -0.00265023 ] ]
0.000002
3.769811
pbe
true
2d08578239dc86f8f0854ba9df2ff6fc_8_Mo2Ir1Rh1
[ "Ir", "N", "Na" ]
5
A2B2C
IrN2Na2
Na2 Ir1 N2
3
[ 1, 1, 1 ]
3
[ [ -1.54442845, 2.05376865, 6.23228752 ], [ 1.54442845, -2.05376865, 6.23228752 ], [ 1.54442845, 2.05376865, -6.23228752 ] ]
agm005415926
[ [ 7.744467047915293e-17, -7.105442511445399e-18, 10.507189654413315 ], [ -6.822594236620461e-18, 5.613062680620117e-18, 1.9573853855866847 ], [ 0, 0, 6.23228752 ], [ -4.660729016093512e-17, -5.323420776572618e-17, 4.439349142602292 ], [ 4.660729016093512e-17, -5.778809469678947e-17, 8.025225897397709 ] ]
[{"mass": null, "name": "Na", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Na"]}, {"mass": null, "name": "Ir", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Ir"]}, {"mass": null, "name": "N", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["N"]}]
[ "Na", "Na", "Ir", "N", "N" ]
2023-11-16 06:57:59
[ 0.2, 0.4, 0.4 ]
[ [ 0.19550617, 0, 0 ], [ 0, 0.5455663, 0 ], [ 0, 0, 0.29113656 ] ]
-26.818366
[ -0.001, -0.001, -0.032, 0.117, 0.117 ]
[ [ 0, 0, 0.00202688 ], [ 0, 0, -0.00202688 ], [ 0, 0, 0 ], [ 0, 0, -0.00281194 ], [ 0, 0, 0.00281194 ] ]
0.295246
1.309422
pbe
true
ad48a0f2f5d45520aaf145da97b5fb35_71_Na2Ir1N2
[ "Ir", "N", "Rh" ]
8
A2BC
IrN2Rh
Ir2 Rh2 N4
3
[ 1, 1, 1 ]
3
[ [ 4.64210218, 0, 0 ], [ 0, 4.64210218, 0 ], [ 2.32105109, 2.32105109, 4.63546691 ] ]
agm002858240
[ [ 0, 0, 0 ], [ 4.64210218, 2.32105109, 2.317733455 ], [ 2.32105109, 2.32105109, 0 ], [ 2.32105109, 4.64210218, 2.317733455 ], [ 3.5230792566982467, 1.160525545, 1.1588667275 ], [ 1.1190229233017537, 3.4815766350000006, 1.1588667275 ], [ 3.481576635, 3.4400740133017536, 3.4766001825 ], [ 5.802627725, 5.844130346698247, 3.4766001825 ] ]
[{"mass": null, "name": "Rh", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Rh"]}, {"mass": null, "name": "Ir", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Ir"]}, {"mass": null, "name": "N", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["N"]}]
[ "Ir", "Ir", "Rh", "Rh", "N", "N", "N", "N" ]
2023-11-16 06:57:59
[ 0.25, 0.5, 0.25 ]
[ [ -0.36203992, 0, 0 ], [ 0, -0.36203992, 0 ], [ 0, 0, 0.33668274 ] ]
-60.844103
[ 0, 0, 0, 0, 0, 0, 0, 0 ]
[ [ 0, 0, 0 ], [ 0, 0, 0 ], [ 0, 0, 0 ], [ 0, 0, 0 ], [ 0.00389866, 0, 0 ], [ -0.00389866, 0, 0 ], [ 0, -0.00389866, 0 ], [ 0, 0.00389866, 0 ] ]
0
5.385025
pbe
true
7833c97e4bb66dc6cbf50f521e549c82_122_Ir2Rh2N4
[ "Ir", "N", "Se" ]
5
A3BC
IrNSe3
Ir1 Se3 N1
3
[ 1, 1, 1 ]
3
[ [ 4.85644279, 0, 0 ], [ 0, 4.85644279, 0 ], [ 0, 0, 4.85644279 ] ]
agm002536765
[ [ 0, 0, 0 ], [ 0, 2.428221395, 0 ], [ 0, 0, 2.428221395 ], [ 2.428221395, 0, 0 ], [ 2.428221395, 2.428221395, 2.428221395 ] ]
[{"mass": null, "name": "Se", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Se"]}, {"mass": null, "name": "Ir", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Ir"]}, {"mass": null, "name": "N", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["N"]}]
[ "Ir", "Se", "Se", "Se", "N" ]
2023-11-16 06:57:59
[ 0.2, 0.2, 0.6 ]
[ [ 0.24780896, 0, 0 ], [ 0, 0.24780896, 0 ], [ 0, 0, 0.24780896 ] ]
-18.859674
[ 0, -0.001, 0, 0, 0 ]
[ [ 0, 0, 0 ], [ 0, 0, 0 ], [ 0, 0, 0 ], [ 0, 0, 0 ], [ 0, 0, 0 ] ]
0.000053
8.317452
pbe
true
9e34c616b85df9e61fee81b67913d595_221_Ir1Se3N1
[ "Ir", "N", "Ta" ]
4
A2BC
IrN2Ta
Ta1 Ir1 N2
3
[ 1, 1, 1 ]
3
[ [ 0, 2.76576193, 2.76576193 ], [ 2.76576193, 0, 2.76576193 ], [ 2.76576193, 2.76576193, 0 ] ]
agm002707476
[ [ 1.382880965, 1.382880965, 1.382880965 ], [ 4.148642895, 4.148642895, 4.148642895 ], [ 2.76576193, 2.76576193, 2.76576193 ], [ 0, 0, 0 ] ]
[{"mass": null, "name": "Ta", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Ta"]}, {"mass": null, "name": "Ir", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Ir"]}, {"mass": null, "name": "N", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["N"]}]
[ "N", "N", "Ir", "Ta" ]
2023-11-16 06:57:59
[ 0.25, 0.5, 0.25 ]
[ [ 2.3031318, 0, 0 ], [ 0, 2.3031318, 0 ], [ 0, 0, 2.3031318 ] ]
-34.791852
[ 0, 0, 0, 0 ]
[ [ 0, 0, 0 ], [ 0, 0, 0 ], [ 0, 0, 0 ], [ 0, 0, 0 ] ]
0
3.338684
pbe
true
799ffe13748aa5874b65000b2a874343_225_Ta1Ir1N2
[ "Ir", "Na", "Sr" ]
11
A8B2C
IrNa2Sr8
Na2 Sr8 Ir1
3
[ 1, 1, 1 ]
3
[ [ 6.52574102, -0.19552851, -2.46161946 ], [ -1.23116148, 7.29201888, -3.84301497 ], [ 0.30804432, 0.96354142, 10.76653015 ] ]
agm005898254
[ [ -0.6572106839526292, 5.970400921500248, 2.502299770041784 ], [ 6.259834543952629, 2.089630868499752, 1.9595959499582163 ], [ 5.006975971215746, 2.2230760510395244, -1.8880639982919927 ], [ 4.389185148619768, 5.8821755399713895, -3.8164701563249395 ], [ 0.5956478887842543, 5.836955738960475, 6.349959718291992 ], [ 3.6609998630853755, 3.1716255692811135, 4.845223808171157 ], [ 1.2134387113802318, 2.1778562500286096, 8.278365876324939 ], [ 3.2954431476227977, 6.938178305496059, 3.072354457799867 ], [ 2.3071807123772023, 1.1218534845039398, 1.3895412622001326 ], [ 1.941623996914624, 4.888406220718886, -0.3833280881711572 ], [ 0, 0, 0 ] ]
[{"mass": null, "name": "Na", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Na"]}, {"mass": null, "name": "Ir", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Ir"]}, {"mass": null, "name": "Sr", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Sr"]}]
[ "Na", "Na", "Sr", "Sr", "Sr", "Sr", "Sr", "Sr", "Sr", "Sr", "Ir" ]
2023-11-16 06:57:59
[ 0.09090909090909091, 0.18181818181818182, 0.7272727272727273 ]
[ [ 0.30774474, 0.01280192, 0.08587255 ], [ 0.01280191, 0.4964658, -0.01074655 ], [ 0.08587252, -0.01074656, 0.45206618 ] ]
-25.411042
[ 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0 ]
[ [ -0.00265701, -0.00027786, 0.00032398 ], [ 0.00265701, 0.00027786, -0.00032398 ], [ 0.00243988, -0.00349022, 0.00001958 ], [ 0.00142848, 0.00250017, -0.00313746 ], [ -0.00243988, 0.00349022, -0.00001958 ], [ 0.00247005, 0.00005378, -0.00068927 ], [ -0.00142848, -0.00250017, 0.00313746 ], [ -0.00010093, 0.00124954, 0.0024033 ], [ 0.00010093, -0.00124954, -0.0024033 ], [ -0.00247005, -0.00005378, 0.00068927 ], [ 0, 0, 0 ] ]
0
8.285542
pbe
true
7004c61aa2b655837f5445f652cf9254_12_Na2Sr8Ir1
[ "Ir", "Nb", "Os" ]
10
A2B2C
Ir2Nb2Os
Nb4 Ir4 Os2
3
[ 1, 1, 1 ]
3
[ [ 7.37685175, 0, 0 ], [ 0, 7.37685175, 0 ], [ 0, 0, 3.03240196 ] ]
agm003002868
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[{"mass": null, "name": "Nb", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Nb"]}, {"mass": null, "name": "Os", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Os"]}, {"mass": null, "name": "Ir", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Ir"]}]
[ "Nb", "Nb", "Nb", "Nb", "Ir", "Ir", "Ir", "Ir", "Os", "Os" ]
2023-11-16 06:57:59
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0.000001
11.752101
pbe
true
3172167554136cde4ac8a377a3c9be1d_127_Nb4Ir4Os2
[ "Ir", "Ni", "Rh" ]
3
ABC
IrNiRh
Ni1 Ir1 Rh1
3
[ 1, 1, 1 ]
3
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agm004237764
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[ "Ir", "Ni", "Rh" ]
2023-11-16 06:57:59
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0.569566
6.573759
pbe
true
309a29205dfd85e0356fcfa1b48fb473_216_Ni1Ir1Rh1
[ "Ir", "O", "Rb" ]
11
A5B5C
IrO5Rb5
Rb5 Ir1 O5
3
[ 1, 1, 1 ]
3
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agm003672658
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[ "Rb", "Rb", "Rb", "Rb", "Rb", "Ir", "O", "O", "O", "O", "O" ]
2023-11-16 06:57:59
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3.227885
1.92295
pbe
true
4e41c40df2ec7e511e903c1cbb0d154f_12_Rb5Ir1O5
[ "Ir", "O", "Te" ]
12
ABC
IrOTe
Te4 Ir4 O4
3
[ 1, 1, 1 ]
3
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agm001005125
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[ "O", "O", "O", "O", "Te", "Te", "Te", "Te", "Ir", "Ir", "Ir", "Ir" ]
2023-11-16 06:57:59
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-70.320175
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0
5.595089
pbe
true
a2b68b6f185d78614a7e81bf1145a11f_14_Te4Ir4O4
[ "Ir", "O", "V" ]
27
A6B2C
IrO6V2
V6 Ir3 O18
3
[ 1, 1, 1 ]
3
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agm005819591
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[{"mass": null, "name": "O", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["O"]}, {"mass": null, "name": "Ir", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Ir"]}, {"mass": null, "name": "V", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["V"]}]
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2023-11-16 06:57:59
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3.652561
16.524578
pbe
true
4db072045313c5ce48f336ae510b4df6_164_V6Ir3O18
[ "In", "Pd", "Sr", "Zn" ]
5
A2BCD
InPdSrZn2
Sr1 Zn2 In1 Pd1
4
[ 1, 1, 1 ]
3
[ [ 4.3663852, 0, 0 ], [ 0, 4.389483, 0 ], [ -2.1831926, -2.1947415, 5.86646316 ] ]
agm005004616
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[ "Sr", "Zn", "Zn", "In", "Pd" ]
2023-11-16 06:57:59
[ 0.2, 0.2, 0.2, 0.4 ]
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2.834233
pbe
true
3420ef6fdc0d4d28ec6e4c0a695e6c98_44_Sr1Zn2In1Pd1
[ "Cd", "Ni", "Y" ]
4
A2BC
CdNi2Y
Y1 Cd1 Ni2
3
[ 1, 1, 1 ]
3
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agm003821729
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[{"mass": null, "name": "Cd", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Cd"]}, {"mass": null, "name": "Ni", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Ni"]}, {"mass": null, "name": "Y", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Y"]}]
[ "Cd", "Ni", "Ni", "Y" ]
2023-11-16 06:57:59
[ 0.25, 0.5, 0.25 ]
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2.628953
pbe
true
1d084e8409784d3320665149be458571_38_Y1Cd1Ni2
[ "Li", "Ru", "Si" ]
4
A2BC
Li2RuSi
Li2 Si1 Ru1
3
[ 1, 1, 1 ]
3
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agm004055101
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[{"mass": null, "name": "Li", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Li"]}, {"mass": null, "name": "Ru", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Ru"]}, {"mass": null, "name": "Si", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Si"]}]
[ "Li", "Li", "Ru", "Si" ]
2023-11-16 06:57:59
[ 0.5, 0.25, 0.25 ]
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-0.000084
2.32222
pbe
true
f98cba41bd46c82a2f87f4ac4619cf90_47_Li2Si1Ru1
[ "Cd", "Ni", "Y" ]
12
A9B2C
Cd2Ni9Y
Y1 Cd2 Ni9
3
[ 1, 1, 1 ]
3
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agm003537524
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[{"mass": null, "name": "Cd", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Cd"]}, {"mass": null, "name": "Ni", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Ni"]}, {"mass": null, "name": "Y", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Y"]}]
[ "Y", "Cd", "Cd", "Ni", "Ni", "Ni", "Ni", "Ni", "Ni", "Ni", "Ni", "Ni" ]
2023-11-16 06:57:59
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3.405565
13.425849
pbe
true
db993c9fec4e26818d5e53f87494e798_166_Y1Cd2Ni9
[ "Cd", "O", "P" ]
4
A2BC
CdO2P
Cd1 P1 O2
3
[ 1, 1, 1 ]
3
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agm002776189
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[ "P", "O", "O", "Cd" ]
2023-11-16 06:57:59
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036cad1ac697935642970d430280397b_166_Cd1P1O2
[ "Cd", "O", "P" ]
50
A17B6C2
Cd2O17P6
Cd2 O17 P6
3
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3
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oqmd-6943237
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2024-11-01 00:00:00
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null
null
pbe
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04f61459ea9ac66cded97e88078e2b1d_14_Cd4P12O34
[ "Dy", "Tm", "Zn" ]
10
A3BC
DyTmZn3
Dy2 Tm2 Zn6
3
[ 1, 1, 1 ]
3
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agm005895817
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[ "Dy", "Dy", "Tm", "Tm", "Zn", "Zn", "Zn", "Zn", "Zn", "Zn" ]
2023-11-16 06:57:59
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0.000001
9.451273
pbe
true
790db88d173f178cb59f74789ffee61e_63_Dy2Tm2Zn6
[ "Ba", "Sc", "Te" ]
10
A2B2C
BaSc2Te2
Ba2 Sc4 Te4
3
[ 1, 1, 1 ]
3
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agm003014532
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[ "Sc", "Sc", "Sc", "Sc", "Te", "Te", "Te", "Te", "Ba", "Ba" ]
2023-11-16 06:57:59
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0
7.470264
pbe
true
ffb8b48af658bcdf5c182e00592c6638_127_Ba2Sc4Te4
[ "Ba", "Sr", "Ta" ]
3
ABC
BaSrTa
Ba1 Sr1 Ta1
3
[ 1, 1, 1 ]
3
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agm003786102
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[ "Ba", "Sr", "Ta" ]
2023-11-16 06:57:59
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4.522699
5.45776
pbe
true
61076054fb90b00cb098237374b3fc2a_216_Ba1Sr1Ta1
[ "Ba", "Tc", "Zn" ]
4
A2BC
Ba2TcZn
Ba2 Tc1 Zn1
3
[ 1, 1, 1 ]
3
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oqmd-5200925
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[{"mass": null, "name": "Ba", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Ba"]}, {"mass": null, "name": "Tc", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Tc"]}, {"mass": null, "name": "Zn", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Zn"]}]
[ "Ba", "Ba", "Tc", "Zn" ]
2024-11-01 00:00:00
[ 0.5, 0.25, 0.25 ]
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1.51971
null
pbe
true
7bf6a8783ff89737470b2e393acb3df8_216_Ba2Zn1Tc1
[ "In", "Rb", "S", "Zr" ]
12
A3BCD
InRbS3Zr
In1 Rb1 S3 Zr1
4
[ 1, 1, 1 ]
3
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oqmd-4875948
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[ "In", "In", "Rb", "Rb", "S", "S", "S", "S", "S", "S", "Zr", "Zr" ]
2024-11-01 00:00:00
[ 0.16666666666666666, 0.16666666666666666, 0.5, 0.16666666666666666 ]
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3.58948
null
pbe
true
4585e097d3a162516d072d1d1e717f66_63_Rb2Zr2In2S6
[ "In", "Rb", "Sm", "Te" ]
12
A3BCD
InRbSmTe3
In1 Rb1 Sm1 Te3
4
[ 1, 1, 1 ]
3
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oqmd-7475209
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[ "In", "In", "Rb", "Rb", "Sm", "Sm", "Te", "Te", "Te", "Te", "Te", "Te" ]
2024-11-01 00:00:00
[ 0.16666666666666666, 0.16666666666666666, 0.16666666666666666, 0.5 ]
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-46.6735
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0.017386
null
pbe
true
c25549e39f83f4b662213c4d388f83e2_63_Rb2Sm2In2Te6
[ "Ba", "Sr", "Y" ]
4
A2BC
BaSr2Y
Ba1 Sr2 Y1
3
[ 1, 1, 1 ]
3
[ [ 6.46620118, 0, 0 ], [ 3.23310059, 5.59989449, 0 ], [ 3.23310059, 1.8666315, 5.27963116 ] ]
agm003850943
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[{"mass": null, "name": "Ba", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Ba"]}, {"mass": null, "name": "Sr", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Sr"]}, {"mass": null, "name": "Y", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Y"]}]
[ "Ba", "Sr", "Sr", "Y" ]
2023-11-16 06:57:59
[ 0.25, 0.5, 0.25 ]
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-0.000012
4.381939
pbe
true
4c36ed2feb7c739fe91985424fa3aa7c_216_Ba1Sr2Y1
[ "Ba", "Sr", "Zn" ]
4
A2BC
BaSrZn2
Ba1 Sr1 Zn2
3
[ 1, 1, 1 ]
3
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agm003172467
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[ "Sr", "Zn", "Zn", "Ba" ]
2023-11-16 06:57:59
[ 0.25, 0.25, 0.5 ]
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0.000026
3.6261
pbe
true
e6142055ddb8857a35b419878d2e0f62_123_Ba1Sr1Zn2
[ "In", "S", "Sn", "Tl" ]
20
A6B2CD
In2S6SnTl
Tl2 In4 Sn2 S12
4
[ 1, 1, 1 ]
3
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agm004979274
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2023-11-16 06:57:59
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5.938859
pbe
true
73d5fd0429376da80ff1df16802066e1_15_Tl2In4Sn2S12
[ "In", "S", "Tb", "Tl" ]
12
A3BCD
InS3TbTl
In1 S3 Tb1 Tl1
4
[ 1, 1, 1 ]
3
[ [ 2.020958685, -7.338636925, 0 ], [ 2.020958685, 7.338636925, 0 ], [ 0, 0, 10.994719214 ] ]
oqmd-7486776
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[ "In", "In", "S", "S", "S", "S", "S", "S", "Tb", "Tb", "Tl", "Tl" ]
2024-11-01 00:00:00
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-56.4781
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0.008278
null
pbe
true
72943b40d3d972382a34d7a826be3286_63_Tb2Tl2In2S6
[ "Er", "Rh", "Te" ]
4
A2BC
ErRh2Te
Er1 Te1 Rh2
3
[ 1, 1, 1 ]
3
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agm001221198
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[{"mass": null, "name": "Te", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Te"]}, {"mass": null, "name": "Rh", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Rh"]}, {"mass": null, "name": "Er", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Er"]}]
[ "Te", "Rh", "Rh", "Er" ]
2023-11-16 06:57:59
[ 0.25, 0.5, 0.25 ]
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-24.963631
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-0.000103
3.874952
pbe
true
8a6657cbff2e2424b0578ab2623cff39_123_Er1Te1Rh2
[ "K", "S", "Tc" ]
44
A6B3C2
K2S6Tc3
K8 S24 Tc12
3
[ 1, 1, 1 ]
3
[ [ 9.68665164, -0.02280519, 0.21042268 ], [ 4.69732474, 8.47153373, 0.21042268 ], [ 0.00763025, 0.00448178, 12.02862551 ] ]
mp-541353
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[{"mass": null, "name": "K", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["K"]}, {"mass": null, "name": "S", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["S"]}, {"mass": null, "name": "Tc", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Tc"]}]
[ "K", "K", "K", "K", "K", "K", "K", "K", "Tc", "Tc", "Tc", "Tc", "Tc", "Tc", "Tc", "Tc", "Tc", "Tc", "Tc", "Tc", "S", "S", "S", "S", "S", "S", "S", "S", "S", "S", "S", "S", "S", "S", "S", "S", "S", "S", "S", "S", "S", "S", "S", "S" ]
2014-03-04 20:03:02
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-269.352142
[]
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null
3.552449
pbe
true
c034921ff538536c578ede99b7958be4_15_K8Tc12S24
[ "Cd", "Os", "Pd" ]
5
A3BC
CdOs3Pd
Cd1 Os3 Pd1
3
[ 1, 1, 1 ]
3
[ [ 4.78038201, 0, 0 ], [ 0, 4.78038201, 0 ], [ 0, 0, 4.78038201 ] ]
agm002574124
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[{"mass": null, "name": "Cd", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Cd"]}, {"mass": null, "name": "Os", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Os"]}, {"mass": null, "name": "Pd", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Pd"]}]
[ "Os", "Os", "Os", "Pd", "Cd" ]
2023-11-16 06:57:59
[ 0.2, 0.6, 0.2 ]
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-27.094471
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5.980207
5.61284
pbe
true
9e3cdf2a4d094999a8883bc9a0b31087_221_Cd1Os3Pd1
[ "Er", "Sm", "Y" ]
4
A2BC
ErSmY2
Sm1 Y2 Er1
3
[ 1, 1, 1 ]
3
[ [ 5.6954625, 0, 0 ], [ 2.84773125, 4.93241521, 0 ], [ 2.84773125, 1.6441384, 4.65032566 ] ]
agm001100658
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[ "Y", "Y", "Sm", "Er" ]
2023-11-16 06:57:59
[ 0.25, 0.25, 0.5 ]
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-21.680807
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0.000113
9.487814
pbe
true
3c6458d90668762d98895cf188378ccf_225_Sm1Y2Er1
[ "Ge", "Hg", "Y" ]
5
A2B2C
Ge2HgY2
Y2 Hg1 Ge2
3
[ 1, 1, 1 ]
3
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agm002923380
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[{"mass": null, "name": "Ge", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Ge"]}, {"mass": null, "name": "Hg", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Hg"]}, {"mass": null, "name": "Y", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Y"]}]
[ "Y", "Y", "Ge", "Ge", "Hg" ]
2023-11-16 06:57:59
[ 0.4, 0.2, 0.4 ]
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0
4.705029
pbe
true
c1c48d6c5933fd816bf63f570c6a182b_139_Y2Hg1Ge2
[ "Ge", "Ho", "In" ]
4
A2BC
GeHo2In
Ho2 In1 Ge1
3
[ 1, 1, 1 ]
3
[ [ 5.18222255, 0, 0 ], [ 2.59111127, 4.48793637, 0 ], [ 2.59111127, 1.49597879, 4.23126699 ] ]
agm002338699
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2023-11-16 06:57:59
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Eu1 Hg2 Mg1
3
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mp-861928
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2014-08-22 13:39:59
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A3BCD
InTbTe3Tl
In1 Tb1 Te3 Tl1
4
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3
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oqmd-4915227
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2024-11-01 00:00:00
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0.019143
null
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0e99f5ca583edd3cf5a8634933d9c22e_63_Tb2Tl2In2Te6
[ "Ba", "Ta", "Zn" ]
4
A2BC
BaTa2Zn
Ba1 Ta2 Zn1
3
[ 1, 1, 1 ]
3
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agm004132360
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[ "Ba", "Ta", "Ta", "Zn" ]
2023-11-16 06:57:59
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75da9fe0d9df6c5d4b205d1df605ec5f_216_Ba1Ta2Zn1
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ABC
GeHoIn
Ho2 In2 Ge2
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agm001001293
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2023-11-16 06:57:59
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e652481caf446d02e0cbd0711b73b719_63_Ho2In2Ge2
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A2BC
EuSm2Tl
Sm2 Eu1 Tl1
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3
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agm001225265
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2023-11-16 06:57:59
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d31bbf47763304ea923150896bcc8507_123_Sm2Eu1Tl1
[ "Eu", "Sn", "Te" ]
80
A12B5C3
Eu3Sn5Te12
Eu12 Sn20 Te48
3
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2023-11-16 06:57:59
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152.10844
pbe
true
5567b8b6b754c0f07926909a03664026_230_Eu12Sn20Te48
[ "Ir", "K", "Na", "O" ]
36
A4B2C2D
IrK2Na2O4
Ir4 K8 Na8 O16
4
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mp-559878
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2014-03-06 08:42:20
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[]
-179.399592
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[]
10.752
2.107987
pbe
true
a25dd86a0a76119521f4006cf8e0aa8f_14_K8Na8Ir4O16
[ "Ir", "K", "Na", "O" ]
36
A4B2C2D
IrK2Na2O4
K8 Na8 Ir4 O16
4
[ 1, 1, 1 ]
3
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agm003275597
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2023-11-16 06:57:59
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12.089138
0.649458
pbe
true
a25dd86a0a76119521f4006cf8e0aa8f_14_K8Na8Ir4O16
[ "Ir", "K", "Nd", "O" ]
24
A7B2C2D
IrK2Nd2O7
K4 Nd4 Ir2 O14
4
[ 1, 1, 1 ]
3
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agm003232983
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[{"mass": null, "name": "O", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["O"]}, {"mass": null, "name": "K", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["K"]}, {"mass": null, "name": "Nd", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Nd"]}, {"mass": null, "name": "Ir", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Ir"]}]
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2023-11-16 06:57:59
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6.021854
0.571001
pbe
true
24d597ab08bc3022b29bf2089dc41111_167_K4Nd4Ir2O14
[ "Ir", "K", "O", "Pr" ]
20
A6B2CD
IrK2O6Pr
K4 Pr2 Ir2 O12
4
[ 1, 1, 1 ]
3
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agm004935180
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[{"mass": null, "name": "O", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["O"]}, {"mass": null, "name": "Pr", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Pr"]}, {"mass": null, "name": "K", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["K"]}, {"mass": null, "name": "Ir", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Ir"]}]
[ "K", "K", "K", "K", "Pr", "Pr", "Ir", "Ir", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O" ]
2023-11-16 06:57:59
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0.002097
13.202004
pbe
true
2e0008439093e03a894d612101a9c895_12_K4Pr2Ir2O12
[ "Ge", "Ho", "Mo" ]
4
A2BC
Ge2HoMo
Ho1 Ge2 Mo1
3
[ 1, 1, 1 ]
3
[ [ 3.6885209, 0, 0 ], [ 1.84426045, 3.1943528, 0 ], [ 1.84426045, 1.06478427, 6.79163109 ] ]
agm001925722
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[{"mass": null, "name": "Ge", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Ge"]}, {"mass": null, "name": "Mo", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Mo"]}, {"mass": null, "name": "Ho", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Ho"]}]
[ "Mo", "Ge", "Ge", "Ho" ]
2023-11-16 06:57:59
[ 0.5, 0.25, 0.25 ]
[ [ 2.5436482, 0, 0 ], [ 0, 2.5436482, 0 ], [ 0, 0, 2.389474 ] ]
-25.729637
[ 0, 0, 0, 0 ]
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-0.000007
2.209709
pbe
true
2b50e4fead8b25cf9cf92ae3966691cb_166_Ho1Ge2Mo1
[ "Mo", "Ni", "W" ]
3
ABC
MoNiW
Ni1 Mo1 W1
3
[ 1, 1, 1 ]
3
[ [ 4.41428789, 0, 0 ], [ -2.20714394, 3.82288545, 0 ], [ 0, 0, 2.59413757 ] ]
agm004212765
[ [ 0, 0, 2.532886376121078 ], [ 2.207143968738106, 1.2742951372570483, 1.0661305648093815 ], [ -1.8738106233824043e-8, 2.5485903127429514, 1.5892582250109164 ] ]
[{"mass": null, "name": "Mo", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Mo"]}, {"mass": null, "name": "Ni", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Ni"]}, {"mass": null, "name": "W", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["W"]}]
[ "Mo", "Ni", "W" ]
2023-11-16 06:57:59
[ 0.3333333333333333, 0.3333333333333333, 0.3333333333333333 ]
[ [ -3.8054771, 0, 0 ], [ 0, -3.8054771, 0 ], [ 0, 0, -3.8727028 ] ]
-29.042028
[ 0, 0, 0 ]
[ [ 0, 0, 0.00386169 ], [ 0, 0, -0.0048484 ], [ 0, 0, 0.00098671 ] ]
-0.000058
2.803377
pbe
true
d580ec08bedb0e90fa4ed75cb5ab8c08_156_Ni1Mo1W1
[ "Eu", "Sn", "Zn" ]
4
A2BC
Eu2SnZn
Eu2 Zn1 Sn1
3
[ 1, 1, 1 ]
3
[ [ 3.86179221, 0, 0 ], [ 0, 5.47739856, 0 ], [ 0, 0, 5.47739856 ] ]
agm001233111
[ [ 0, 0, 2.73869928 ], [ 0, 2.73869928, 0 ], [ 1.930896105, 2.73869928, 2.73869928 ], [ 1.930896105, 0, 0 ] ]
[{"mass": null, "name": "Sn", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Sn"]}, {"mass": null, "name": "Zn", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Zn"]}, {"mass": null, "name": "Eu", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Eu"]}]
[ "Eu", "Eu", "Zn", "Sn" ]
2023-11-16 06:57:59
[ 0.5, 0.25, 0.25 ]
[ [ 2.3742206, 0, 0 ], [ 0, 2.0215933, 0 ], [ 0, 0, 2.0215933 ] ]
-27.744877
[ 6.853, 6.853, 0.012, -0.041 ]
[ [ 0, 0, 0 ], [ 0, 0, 0 ], [ 0, 0, 0 ], [ 0, 0, 0 ] ]
14.189555
12.236317
pbe
true
fabc155e824733fb043c9a4a6e48a008_123_Eu2Zn1Sn1
[ "Ir", "K", "O", "Y" ]
10
A6B2CD
IrK2O6Y
K2 Y1 Ir1 O6
4
[ 1, 1, 1 ]
3
[ [ 5.89292907, 0, 0 ], [ 2.94646454, 5.10342628, 0 ], [ 2.94646454, 1.70114209, 4.81155644 ] ]
agm004934254
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[{"mass": null, "name": "O", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["O"]}, {"mass": null, "name": "K", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["K"]}, {"mass": null, "name": "Ir", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Ir"]}, {"mass": null, "name": "Y", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Y"]}]
[ "K", "K", "Y", "Ir", "O", "O", "O", "O", "O", "O" ]
2023-11-16 06:57:59
[ 0.1, 0.2, 0.6, 0.1 ]
[ [ 0.7957887, 0, 0 ], [ 0, 0.7957887, 0 ], [ 0, 0, 0.7957887 ] ]
-64.299151
[ 0, 0, 0, 0.001, 0, 0, 0, 0, 0, 0 ]
[ [ 0, 0, 0 ], [ 0, 0, 0 ], [ 0, 0, 0 ], [ 0, 0, 0 ], [ 0, -0.0021475, -0.00151851 ], [ 0.00185979, -0.00107375, 0.00151851 ], [ 0.00185979, 0.00107375, -0.00151851 ], [ -0.00185979, -0.00107375, 0.00151851 ], [ 0, 0.0021475, 0.00151851 ], [ -0.00185979, 0.00107375, -0.00151851 ] ]
0.00259
5.652531
pbe
true
4f3c1876f09acef06731c33b9472cb9e_225_K2Y1Ir1O6
[ "Eu", "Sr", "Tb" ]
4
A2BC
EuSr2Tb
Sr2 Tb1 Eu1
3
[ 1, 1, 1 ]
3
[ [ 4.2914738, 0, 0 ], [ 0, 4.2914738, 0 ], [ 0, 0, 9.58880954 ] ]
agm001156902
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[{"mass": null, "name": "Tb", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Tb"]}, {"mass": null, "name": "Sr", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Sr"]}, {"mass": null, "name": "Eu", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Eu"]}]
[ "Eu", "Sr", "Sr", "Tb" ]
2023-11-16 06:57:59
[ 0.25, 0.5, 0.25 ]
[ [ 0.6585646, 0, 0 ], [ 0, 0.6585646, 0 ], [ 0, 0, 1.5220705 ] ]
-17.605434
[ 6.969, 0.006, 0.006, -0.135 ]
[ [ 0, 0, 0 ], [ 0, 0, 0.00884976 ], [ 0, 0, -0.00884976 ], [ 0, 0, 0 ] ]
7.199038
4.010384
pbe
true
29a734b35e40cc35350bc962077bda9e_123_Sr2Tb1Eu1
[ "N", "Th", "Zr" ]
3
ABC
NThZr
Th1 Zr1 N1
3
[ 1, 1, 1 ]
3
[ [ 5.8625829, 0, 0 ], [ 0, 3.44857156, 0 ], [ 0, -1.72428578, 2.98655058 ] ]
agm001274825
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[{"mass": null, "name": "Zr", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Zr"]}, {"mass": null, "name": "Th", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Th"]}, {"mass": null, "name": "N", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["N"]}]
[ "Zr", "Th", "N" ]
2023-11-16 06:57:59
[ 0.3333333333333333, 0.3333333333333333, 0.3333333333333333 ]
[ [ 0.02934678, 0, 0 ], [ 0, 0.38876298, 0 ], [ 0, 0, 0.38876298 ] ]
-26.92434
[ 0.159, 0.247, 0.032 ]
[ [ 0.00354035, 0, 0 ], [ 0.000255, 0, 0 ], [ -0.00379535, 0, 0 ] ]
0.777775
2.745803
pbe
true
4713574e6034c8cb3f80207f8d902421_156_Th1Zr1N1
[ "Na", "Ni", "Sb" ]
3
ABC
NaNiSb
Na1 Ni1 Sb1
3
[ 1, 1, 1 ]
3
[ [ 4.4056884, 0, 0 ], [ 0, 4.26594916, 0 ], [ 0, -2.13297458, 3.69442035 ] ]
agm001267093
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[{"mass": null, "name": "Na", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Na"]}, {"mass": null, "name": "Sb", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Sb"]}, {"mass": null, "name": "Ni", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Ni"]}]
[ "Sb", "Na", "Ni" ]
2023-11-16 06:57:59
[ 0.3333333333333333, 0.3333333333333333, 0.3333333333333333 ]
[ [ -1.9921048, 0, 0 ], [ 0, -2.6880393, 0 ], [ 0, 0, -2.6880393 ] ]
-11.558089
[ 0, 0, 0 ]
[ [ 0, 0, 0 ], [ 0, 0, 0 ], [ 0, 0, 0 ] ]
-0.000005
2.433874
pbe
true
db03c0aff83f0cee1f893e59297b8fe9_187_Na1Ni1Sb1
[ "Nb", "Pu", "Sm" ]
3
ABC
NbPuSm
Nb1 Pu1 Sm1
3
[ 1, 1, 1 ]
3
[ [ 0, 3.473824623, 3.473824623 ], [ 3.473824623, 0, 3.473824623 ], [ 3.473824623, 3.473824623, 0 ] ]
oqmd-6965875
[ [ 0, 0, 0 ], [ 1.73691, 1.73691, 1.73691 ], [ 5.21074, 5.21074, 5.21074 ] ]
[{"mass": null, "name": "Nb", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Nb"]}, {"mass": null, "name": "Pu", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Pu"]}, {"mass": null, "name": "Sm", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Sm"]}]
[ "Nb", "Pu", "Sm" ]
2024-11-01 00:00:00
[ 0.3333333333333333, 0.3333333333333333, 0.3333333333333333 ]
[ [ 20.94153872, 0, 0 ], [ 0, 20.94153872, 0 ], [ 0, 0, 20.94153872 ] ]
-26.5963
[ -0.96, 5.015, -0.098 ]
[ [ 0, 0, 0 ], [ 0, 0, 0 ], [ 0, 0, 0 ] ]
4.01265
null
pbe
true
61c77919b6b5d2b5fb16e3cb465960c3_216_Sm1Pu1Nb1
[ "Nb", "Pu", "W" ]
3
ABC
NbPuW
Nb1 Pu1 W1
3
[ 1, 1, 1 ]
3
[ [ 0, 3.159168411, 3.159168411 ], [ 3.159168411, 0, 3.159168411 ], [ 3.159168411, 3.159168411, 0 ] ]
oqmd-5735933
[ [ 4.73875, 4.73875, 4.73875 ], [ 1.57958, 1.57958, 1.57958 ], [ 0, 0, 0 ] ]
[{"mass": null, "name": "Nb", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Nb"]}, {"mass": null, "name": "Pu", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Pu"]}, {"mass": null, "name": "W", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["W"]}]
[ "Nb", "Pu", "W" ]
2024-11-01 00:00:00
[ 0.3333333333333333, 0.3333333333333333, 0.3333333333333333 ]
[ [ 107.07488285, 0, 0 ], [ 0, 107.07488285, 0 ], [ 0, 0, 107.07488285 ] ]
-35.1637
[ -0.028, 4.829, -0.203 ]
[ [ 0, 0, 0 ], [ 0, 0, 0 ], [ 0, 0, 0 ] ]
4.72369
null
pbe
true
c70141d462ad4b197274dc042dc626db_216_Pu1Nb1W1
[ "Ir", "La", "Os", "Si" ]
5
A2BCD
IrLaOsSi2
La1 Si2 Ir1 Os1
4
[ 1, 1, 1 ]
3
[ [ 4.20107833, 0, 0 ], [ 0, 4.20107833, 0 ], [ -2.10053916, -2.10053916, 5.06335258 ] ]
agm005019038
[ [ 0, 0, 0 ], [ 2.1005391873226706, 2.1005391873226706, 1.333970161614748 ], [ -1.7322671125616167e-8, -1.7322671125616167e-8, 3.7293824183852524 ], [ 2.4999999848063226e-9, 2.1005391675, 2.53167629 ], [ 2.1005391675, 2.4999999848063226e-9, 2.53167629 ] ]
[{"mass": null, "name": "La", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["La"]}, {"mass": null, "name": "Os", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Os"]}, {"mass": null, "name": "Ir", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Ir"]}, {"mass": null, "name": "Si", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Si"]}]
[ "La", "Si", "Si", "Ir", "Os" ]
2023-11-16 06:57:59
[ 0.2, 0.2, 0.2, 0.4 ]
[ [ 5.527115, 0, 0 ], [ 0, 5.527115, 0 ], [ 0, 0, 5.086128 ] ]
-40.338502
[ 0, 0, 0, 0, 0 ]
[ [ 0, 0, 0 ], [ 0, 0, -0.00373378 ], [ 0, 0, 0.00373378 ], [ 0, 0, 0 ], [ 0, 0, 0 ] ]
0
2.734425
pbe
true
92fa9cff5f1b8af84df829fe860b0047_119_La1Si2Ir1Os1
[ "Ca", "Te", "Zr" ]
4
A2BC
CaTeZr2
Ca1 Zr2 Te1
3
[ 1, 1, 1 ]
3
[ [ 3.78655051, -0.00265598, 0 ], [ 0.00277181, 3.78655435, 0 ], [ 0, 0, 7.11760951 ] ]
agm004265161
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[{"mass": null, "name": "Zr", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Zr"]}, {"mass": null, "name": "Ca", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Ca"]}, {"mass": null, "name": "Te", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Te"]}]
[ "Ca", "Te", "Zr", "Zr" ]
2023-11-16 06:57:59
[ 0.25, 0.25, 0.5 ]
[ [ 1.5205138, 0.00004651, 0 ], [ 0.00004651, 1.5205168, 0 ], [ 0, 0, 1.5147161 ] ]
-22.801227
[ 0, 0, 0, 0 ]
[ [ 0, 0, 0 ], [ 0, 0, 0 ], [ 0, 0, 0.00121345 ], [ 0, 0, -0.00121345 ] ]
0.000183
4.062477
pbe
true
ca7e24c3206c304f4ea083aea3ee3204_123_Ca1Zr2Te1
[ "Ir", "La", "Ta", "Ti" ]
5
A2BCD
Ir2LaTaTi
La1 Ta1 Ti1 Ir2
4
[ 1, 1, 1 ]
3
[ [ 4.41145859, 0, 0 ], [ 0, 4.41145859, 0 ], [ -2.2057293, -2.2057293, 5.35500683 ] ]
agm005017555
[ [ 0, 0, 0 ], [ 2.2057292925, -2.4999999848063226e-9, 2.677503415 ], [ -2.4999999848063226e-9, 2.2057292925, 2.677503415 ], [ 2.2057292937442163, 2.2057292937442163, 1.3449457368001245 ], [ -3.744216669491786e-9, -3.744216669491786e-9, 4.010061093199876 ] ]
[{"mass": null, "name": "Ta", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Ta"]}, {"mass": null, "name": "La", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["La"]}, {"mass": null, "name": "Ir", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Ir"]}, {"mass": null, "name": "Ti", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Ti"]}]
[ "La", "Ta", "Ti", "Ir", "Ir" ]
2023-11-16 06:57:59
[ 0.4, 0.2, 0.2, 0.2 ]
[ [ 5.0046244, 0, 0 ], [ 0, 5.0046244, 0 ], [ 0, 0, 5.0121446 ] ]
-45.993566
[ 0, 0, 0, 0, 0 ]
[ [ 0, 0, 0 ], [ 0, 0, 0 ], [ 0, 0, 0 ], [ 0, 0, 0.00169484 ], [ 0, 0, -0.00169484 ] ]
-0.000002
4.054531
pbe
true
35e2a111879fbe872438121b198176dd_119_La1Ta1Ti1Ir2