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{
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"next": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-energy_above_hull&page=3500",
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{
"id": "jvasp-58999",
"created_at": "2022-09-04T14:38:35.832456Z",
"updated_at": "2022-09-04T14:38:35.832467Z",
"structure_string": "Rb6 Nb4 Br18\n1.0\n3.801969 -6.585204 0.000000\n3.801969 6.585204 -0.000000\n-0.000000 0.000000 17.758921\nRb Nb Br\n6 4 18\ndirect\n0.000000 0.000000 0.250000 Rb\n0.000000 0.000000 0.750000 Rb\n0.333333 0.666667 0.070671 Rb\n0.666667 0.333333 0.570671 Rb\n0.666667 0.333333 0.929329 Rb\n0.333333 0.666667 0.429329 Rb\n0.333333 0.666667 0.673491 Nb\n0.666667 0.333333 0.173491 Nb\n0.333333 0.666667 0.826509 Nb\n0.666667 0.333333 0.326509 Nb\n0.830607 0.169393 0.090485 Br\n0.830607 0.169393 0.409515 Br\n0.169393 0.830607 0.909515 Br\n0.661215 0.830608 0.590485 Br\n0.169393 0.338785 0.909515 Br\n0.661215 0.830608 0.909515 Br\n0.830608 0.661215 0.090485 Br\n0.169393 0.830607 0.590485 Br\n0.489740 0.510260 0.250000 Br\n0.338785 0.169393 0.090485 Br\n0.979479 0.489740 0.750000 Br\n0.489740 0.979479 0.250000 Br\n0.338785 0.169393 0.409515 Br\n0.510260 0.489740 0.750000 Br\n0.510260 0.020521 0.750000 Br\n0.020521 0.510260 0.250000 Br\n0.169393 0.338785 0.590485 Br\n0.830608 0.661215 0.409515 Br\n",
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{
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"structure_string": "K4 Ru2 Cl10 O1\n1.0\n6.608166 0.000000 -2.543867\n-0.979283 6.535203 -2.543867\n-0.004022 -0.004670 9.844453\nK Ru Cl O\n4 2 10 1\ndirect\n0.500000 -0.000000 -0.000000 K\n0.250001 0.750000 0.500000 K\n0.750001 0.250000 0.500000 K\n0.000000 0.500000 -0.000000 K\n0.893678 0.893676 0.787353 Ru\n0.106324 0.106323 0.212647 Ru\n0.243492 0.243492 0.486985 Cl\n0.353202 0.353202 0.228512 Cl\n0.353202 0.875310 0.228512 Cl\n0.756509 0.756508 0.513015 Cl\n0.124690 0.646798 0.771487 Cl\n0.875312 0.875310 0.228512 Cl\n0.646799 0.646798 0.771487 Cl\n0.646799 0.124689 0.771487 Cl\n0.875311 0.353202 0.228512 Cl\n0.124690 0.124689 0.771487 Cl\n0.000000 0.000000 0.000000 O\n",
"nsites": 17,
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"elements": [
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"chemical_system": "Cl-K-O-Ru",
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"density_atomic": 0.04000163269642007,
"volume": 424.9826533085838,
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"formula_full": "K4 Ru2 Cl10 O1",
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},
{
"id": "jvasp-16272",
"created_at": "2022-09-04T14:37:52.144718Z",
"updated_at": "2022-09-04T14:37:52.144742Z",
"structure_string": "Pr1 As1\n1.0\n3.726811 -0.000000 2.151675\n1.242271 3.513671 2.151675\n0.000000 0.000000 4.303352\nPr As\n1 1\ndirect\n0.500000 0.500000 0.500001 Pr\n0.000000 0.000000 0.000000 As\n",
"nsites": 2,
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"elements": [
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"volume": 56.35148098115993,
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"spacegroup": 225
},
{
"id": "jvasp-98982",
"created_at": "2022-09-04T14:35:47.597211Z",
"updated_at": "2022-09-04T14:35:47.597231Z",
"structure_string": "Ba8 Zn4 O12\n1.0\n5.863206 -0.000000 0.361740\n2.931604 5.755350 0.180870\n-0.024339 0.000000 12.717259\nBa Zn O\n8 4 12\ndirect\n0.862681 0.791962 0.424994 Ba\n0.137319 0.208037 0.575006 Ba\n0.654642 0.208037 0.924994 Ba\n0.562351 0.410365 0.347471 Ba\n0.972716 0.589635 0.847471 Ba\n0.437649 0.589635 0.652530 Ba\n0.027284 0.410365 0.152530 Ba\n0.345358 0.791962 0.075006 Ba\n0.726191 0.004125 0.163621 Zn\n0.273809 0.995875 0.836379 Zn\n0.269685 0.004125 0.336379 Zn\n0.730315 0.995875 0.663621 Zn\n0.131881 0.197285 0.965342 O\n0.856408 0.657179 0.633149 O\n0.486413 0.657179 0.866851 O\n0.143592 0.342821 0.366851 O\n0.404546 0.190910 0.750000 O\n0.996289 0.007424 0.250000 O\n0.003711 0.992576 0.750000 O\n0.329164 0.802715 0.465342 O\n0.868119 0.802715 0.034658 O\n0.670836 0.197285 0.534658 O\n0.513587 0.342821 0.133149 O\n0.595454 0.809090 0.250000 O\n",
"nsites": 24,
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"formula_full": "Ba8 Zn4 O12",
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{
"id": "jvasp-64049",
"created_at": "2022-09-04T14:35:54.844646Z",
"updated_at": "2022-09-04T14:35:54.844669Z",
"structure_string": "Ba4 Fe1 Br1\n1.0\n0.000000 4.985081 4.985081\n4.985081 0.000000 4.985081\n4.985081 4.985081 -0.000000\nBa Fe Br\n4 1 1\ndirect\n0.123488 0.625504 0.625504 Ba\n0.625504 0.625504 0.625504 Ba\n0.625504 0.123488 0.625504 Ba\n0.625504 0.625504 0.123488 Ba\n0.000000 0.000000 0.000000 Fe\n0.250000 0.250000 0.250000 Br\n",
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"volume": 247.7688206555906,
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"formula_full": "Ba4 Fe1 Br1",
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"spacegroup": 216
},
{
"id": "jvasp-117747",
"created_at": "2022-09-04T14:38:47.601345Z",
"updated_at": "2022-09-04T14:38:47.601381Z",
"structure_string": "Rb1 Bi1 S1\n1.0\n3.818833 -0.000000 -0.000000\n-0.000000 3.818833 0.000000\n-0.000000 -0.000000 8.808868\nRb Bi S\n1 1 1\ndirect\n0.000000 0.000000 0.670645 Rb\n0.000000 0.000000 0.271873 Bi\n0.000000 0.000000 0.001379 S\n",
"nsites": 3,
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"elements": [
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"density_atomic": 0.02335284618983057,
"volume": 128.4639985898766,
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"spacegroup": 99
},
{
"id": "jvasp-15848",
"created_at": "2022-09-04T14:38:30.303764Z",
"updated_at": "2022-09-04T14:38:30.303804Z",
"structure_string": "Sc2 Te2\n1.0\n2.069984 -3.585318 -0.000000\n2.069984 3.585318 -0.000000\n-0.000000 0.000000 6.914479\nSc Te\n2 2\ndirect\n0.000000 0.000000 0.000000 Sc\n0.000000 0.000000 0.500000 Sc\n0.333332 0.666666 0.750000 Te\n0.666666 0.333332 0.250000 Te\n",
"nsites": 4,
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},
{
"id": "jvasp-116464",
"created_at": "2022-09-04T14:38:42.251301Z",
"updated_at": "2022-09-04T14:38:42.251321Z",
"structure_string": "Nd4 Ga4 Pd4\n1.0\n4.547925 0.000000 0.000000\n0.000000 7.172159 0.000000\n-0.000000 0.000000 7.747389\nNd Ga Pd\n4 4 4\ndirect\n0.250000 0.018702 0.699120 Nd\n0.250000 0.518703 0.800881 Nd\n0.750001 0.981298 0.300881 Nd\n0.750001 0.481298 0.199119 Nd\n0.250000 0.177179 0.079033 Ga\n0.250000 0.677179 0.420967 Ga\n0.750001 0.822821 0.920967 Ga\n0.750001 0.322821 0.579033 Ga\n0.250000 0.288804 0.406974 Pd\n0.250000 0.788804 0.093026 Pd\n0.750001 0.711197 0.593026 Pd\n0.750001 0.211196 0.906974 Pd\n",
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},
{
"id": "jvasp-37073",
"created_at": "2022-09-04T14:38:03.511578Z",
"updated_at": "2022-09-04T14:38:03.511605Z",
"structure_string": "K1 Tb1 S2\n1.0\n-2.024182 -3.505985 0.000000\n-4.048363 0.000000 0.000000\n-2.024182 -1.168662 -7.289073\nTb K S\n1 1 2\ndirect\n0.000000 0.000000 0.000000 Tb\n0.500000 0.499999 0.500000 K\n0.735101 0.735099 0.794698 S\n0.264900 0.264899 0.205302 S\n",
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{
"id": "jvasp-69412",
"created_at": "2022-09-04T14:36:12.193852Z",
"updated_at": "2022-09-04T14:36:12.193878Z",
"structure_string": "Be2 In1 Hg1\n1.0\n2.914459 0.000000 0.000000\n0.000000 2.914459 -0.000000\n-0.000000 0.000000 8.398389\nBe In Hg\n2 1 1\ndirect\n0.000000 0.000000 0.081714 Be\n0.500000 0.500000 0.173939 Be\n0.500000 0.500000 0.804278 In\n0.000000 0.000000 0.440069 Hg\n",
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},
{
"id": "jvasp-16508",
"created_at": "2022-09-04T14:38:17.456521Z",
"updated_at": "2022-09-04T14:38:17.456538Z",
"structure_string": "Er1 Sn3\n1.0\n4.701648 0.000000 0.000000\n0.000000 4.701648 0.000000\n0.000000 0.000000 4.701648\nEr Sn\n1 3\ndirect\n0.000000 0.000000 0.000000 Er\n0.500000 0.000000 0.500000 Sn\n0.000000 0.500000 0.500000 Sn\n0.500000 0.500000 0.000000 Sn\n",
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{
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"created_at": "2022-09-04T14:36:10.711865Z",
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"structure_string": "Be1 Ga1 Pb2\n1.0\n3.461955 0.000000 -0.000000\n0.000000 3.461955 0.000000\n0.000000 0.000000 7.809853\nBe Ga Pb\n1 1 2\ndirect\n0.000000 0.000000 0.562940 Be\n0.500001 0.500001 0.687222 Ga\n0.000000 0.000000 0.930497 Pb\n0.500001 0.500001 0.319340 Pb\n",
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}