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{
"count": 55712,
"next": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-chemical_system&page=353",
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"results": [
{
"id": "jvasp-51653",
"created_at": "2022-09-04T14:38:17.305702Z",
"updated_at": "2022-09-04T14:38:17.305720Z",
"structure_string": "Zn4 Si4 O12\n1.0\n5.213088 0.233265 1.172842\n1.480289 6.608784 0.411946\n0.347659 -0.075500 6.775722\nZn Si O\n4 4 12\ndirect\n0.250000 0.765462 0.234538 Zn\n0.250000 0.108846 0.891153 Zn\n0.750001 0.891154 0.108846 Zn\n0.750000 0.234538 0.765461 Zn\n0.234841 0.218524 0.387175 Si\n0.734841 0.387175 0.218524 Si\n0.265160 0.612825 0.781476 Si\n0.765160 0.781476 0.612825 Si\n0.143302 0.790376 0.962994 O\n0.875483 0.859742 0.381611 O\n0.643302 0.962994 0.790376 O\n-0.023192 0.383337 0.327514 O\n0.624518 0.618389 0.140258 O\n0.124518 0.140258 0.618388 O\n0.856699 0.209624 0.037006 O\n0.375483 0.381611 0.859742 O\n0.356699 0.037006 0.209624 O\n0.476808 0.327514 0.383337 O\n0.023193 0.616662 0.672486 O\n0.523193 0.672486 0.616662 O\n",
"nsites": 20,
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"elements": [
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],
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"formula_full": "Zn4 Si4 O12",
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"spacegroup": 15
},
{
"id": "jvasp-116408",
"created_at": "2022-09-04T14:38:42.327138Z",
"updated_at": "2022-09-04T14:38:42.327174Z",
"structure_string": "Zn1 Si1 O1\n1.0\n2.777158 -0.000000 0.000000\n-0.000000 2.777158 -0.000000\n0.000000 -0.000000 6.217846\nZn Si O\n1 1 1\ndirect\n0.000000 0.000000 0.600348 Zn\n0.000000 0.000000 0.042377 Si\n0.000000 0.000000 0.297335 O\n",
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"volume": 47.95579982979238,
"volume_molar": 9.626552561113126,
"formula_full": "Zn1 Si1 O1",
"formula_reduced": "ZnSiO",
"formula_anonymous": "ABC",
"energy_above_hull": 0.9951341666666664,
"spacegroup": 99
},
{
"id": "jvasp-116406",
"created_at": "2022-09-04T14:38:42.313989Z",
"updated_at": "2022-09-04T14:38:42.314012Z",
"structure_string": "Zn1 Si1 O1\n1.0\n6.477130 -0.000000 0.000000\n-0.000000 6.477130 0.000000\n0.000000 0.000000 4.762595\nZn Si O\n1 1 1\ndirect\n-0.022267 0.299047 0.000000 Zn\n0.272530 -0.024681 0.000000 Si\n-0.054683 -0.059002 0.000000 O\n",
"nsites": 3,
"nelements": 3,
"elements": [
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],
"chemical_system": "O-Si-Zn",
"density": 0.9099764296500868,
"density_atomic": 0.015014551905253628,
"volume": 199.80616264347475,
"volume_molar": 40.10869453848196,
"formula_full": "Zn1 Si1 O1",
"formula_reduced": "ZnSiO",
"formula_anonymous": "ABC",
"energy_above_hull": 1.5269008333333334,
"spacegroup": 6
},
{
"id": "jvasp-116407",
"created_at": "2022-09-04T14:38:42.910777Z",
"updated_at": "2022-09-04T14:38:42.910804Z",
"structure_string": "Zn1 Si1 O2\n1.0\n2.926916 0.000000 0.000000\n0.000000 2.926916 0.000000\n0.000000 0.000000 5.006098\nZn Si O\n1 1 2\ndirect\n0.500001 0.500001 0.534223 Zn\n0.000000 0.000000 0.029540 Si\n0.000000 0.000000 0.381995 O\n0.500001 0.500001 0.064241 O\n",
"nsites": 4,
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"elements": [
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],
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"density": 4.859032150002723,
"density_atomic": 0.09326960267932734,
"volume": 42.88642692895889,
"volume_molar": 6.456702491491124,
"formula_full": "Zn1 Si1 O2",
"formula_reduced": "ZnSiO2",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.3064865,
"spacegroup": 99
},
{
"id": "jvasp-35184",
"created_at": "2022-09-04T14:38:00.764806Z",
"updated_at": "2022-09-04T14:38:00.764828Z",
"structure_string": "Zn8 Si4 O16\n1.0\n5.116912 -0.000000 0.000000\n0.000000 6.706247 0.000000\n0.000000 0.000000 10.384260\nZn Si O\n8 4 16\ndirect\n0.329452 0.000254 0.655998 Zn\n0.170548 0.499747 0.155998 Zn\n0.670548 0.500254 0.344002 Zn\n0.829452 -0.000254 0.844002 Zn\n0.670548 -0.000254 0.344002 Zn\n0.829452 0.500254 0.844002 Zn\n0.329452 0.499747 0.655998 Zn\n0.170548 0.000254 0.155998 Zn\n0.327519 0.250000 0.908737 Si\n0.172481 0.250000 0.408737 Si\n0.672481 0.750000 0.091263 Si\n0.827519 0.750000 0.591263 Si\n0.210283 0.451029 0.837497 O\n0.289717 0.048971 0.337497 O\n0.210283 0.048971 0.837497 O\n0.289717 0.451029 0.337497 O\n0.789717 0.548971 0.162503 O\n0.710283 0.951029 0.662503 O\n0.261556 0.250000 0.560890 O\n0.352336 0.750000 0.110408 O\n0.738443 0.750000 0.439110 O\n0.761556 0.750000 0.939110 O\n0.647663 0.250000 0.889592 O\n0.852336 0.250000 0.389592 O\n0.710283 0.548971 0.662503 O\n0.147663 0.750000 0.610408 O\n0.238444 0.250000 0.060890 O\n0.789717 0.951029 0.162503 O\n",
"nsites": 28,
"nelements": 3,
"elements": [
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],
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"density": 4.154877788239725,
"density_atomic": 0.07857691695113543,
"volume": 356.3387453520522,
"volume_molar": 7.664007438399477,
"formula_full": "Zn8 Si4 O16",
"formula_reduced": "Zn2SiO4",
"formula_anonymous": "AB2C4",
"energy_above_hull": 1.2579747714285712,
"spacegroup": 62
},
{
"id": "jvasp-35189",
"created_at": "2022-09-04T14:38:03.797330Z",
"updated_at": "2022-09-04T14:38:03.797356Z",
"structure_string": "Zn8 Si4 O16\n1.0\n4.977014 0.000000 0.000000\n-0.000000 5.063446 0.000000\n0.000000 0.000000 10.443896\nZn Si O\n8 4 16\ndirect\n0.499036 0.051564 0.163799 Zn\n0.999035 0.448437 0.836201 Zn\n0.500963 0.551564 0.336201 Zn\n0.000964 0.948437 0.663799 Zn\n0.500963 0.948437 0.836201 Zn\n0.000964 0.551564 0.163799 Zn\n0.499036 0.448437 0.663799 Zn\n0.999035 0.051564 0.336201 Zn\n0.000000 0.000000 0.000000 Si\n0.500000 0.500000 0.000000 Si\n0.000000 0.500000 0.500000 Si\n0.500000 0.000000 0.500000 Si\n0.111633 0.453459 0.340838 O\n0.611633 0.046542 0.659163 O\n0.111633 0.046542 0.840838 O\n0.611633 0.453459 0.159162 O\n0.888366 0.546542 0.659163 O\n0.388366 0.953459 0.340838 O\n0.197375 0.291555 0.047482 O\n0.197375 0.208446 0.547482 O\n0.802625 0.791555 0.452518 O\n0.302625 0.708446 0.547482 O\n0.802625 0.708446 0.952518 O\n0.302625 0.791555 0.047482 O\n0.388366 0.546542 0.840838 O\n0.697374 0.291555 0.452518 O\n0.697374 0.208446 0.952518 O\n0.888366 0.953459 0.159162 O\n",
"nsites": 28,
"nelements": 3,
"elements": [
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"Si",
"O"
],
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"density": 5.625274461826892,
"density_atomic": 0.10638501220551703,
"volume": 263.19496909873874,
"volume_molar": 5.660704111558768,
"formula_full": "Zn8 Si4 O16",
"formula_reduced": "Zn2SiO4",
"formula_anonymous": "AB2C4",
"energy_above_hull": 1.2797776285714284,
"spacegroup": 61
},
{
"id": "jvasp-34560",
"created_at": "2022-09-04T14:37:01.233985Z",
"updated_at": "2022-09-04T14:37:01.234010Z",
"structure_string": "Zn4 Si2 O8\n1.0\n5.705440 -0.008154 -1.779644\n-3.089279 4.796714 -1.779644\n0.004455 0.008154 5.976551\nZn Si O\n4 2 8\ndirect\n0.375000 0.278969 0.403970 Zn\n0.875000 0.971030 0.596032 Zn\n0.721031 0.125000 0.096032 Zn\n0.028969 0.624999 0.903969 Zn\n0.500000 0.500000 0.000001 Si\n0.250000 0.749999 0.500000 Si\n0.091385 0.800761 0.676283 O\n0.584898 0.908614 0.709378 O\n0.658615 0.834897 0.209378 O\n0.550762 0.341385 0.176283 O\n0.165103 0.374478 0.823717 O\n0.199238 0.875520 0.290623 O\n0.124479 0.415102 0.323718 O\n0.625521 0.449238 0.790624 O\n",
"nsites": 14,
"nelements": 3,
"elements": [
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"O"
],
"chemical_system": "O-Si-Zn",
"density": 4.525509039867051,
"density_atomic": 0.08558628342661828,
"volume": 163.57761360210958,
"volume_molar": 7.036338673548532,
"formula_full": "Zn4 Si2 O8",
"formula_reduced": "Zn2SiO4",
"formula_anonymous": "AB2C4",
"energy_above_hull": 1.257081914285714,
"spacegroup": 122
},
{
"id": "jvasp-36615",
"created_at": "2022-09-04T14:37:29.239312Z",
"updated_at": "2022-09-04T14:37:29.239339Z",
"structure_string": "Zn1 Si1 O3\n1.0\n3.537428 -0.000000 0.000000\n0.000000 3.537428 0.000000\n-0.000000 -0.000000 3.537428\nZn Si O\n1 1 3\ndirect\n0.000000 0.000000 0.000000 Zn\n0.500000 0.500000 0.500000 Si\n0.500000 0.500000 0.000000 O\n0.500000 0.000000 0.500000 O\n0.000000 0.500000 0.500000 O\n",
"nsites": 5,
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"elements": [
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"density": 5.307870324640528,
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"volume": 44.26524041063982,
"volume_molar": 5.331430170562264,
"formula_full": "Zn1 Si1 O3",
"formula_reduced": "ZnSiO3",
"formula_anonymous": "ABC3",
"energy_above_hull": 1.4981038999999996,
"spacegroup": 221
},
{
"id": "jvasp-57258",
"created_at": "2022-09-04T14:38:33.570418Z",
"updated_at": "2022-09-04T14:38:33.570446Z",
"structure_string": "Zn4 Si4 O12\n1.0\n5.155287 0.012662 1.428944\n1.759764 6.540591 0.423336\n0.012149 -0.012666 6.786385\nZn Si O\n4 4 12\ndirect\n0.750000 0.890999 0.109000 Zn\n0.750001 0.234412 0.765587 Zn\n0.250000 0.765587 0.234414 Zn\n0.250000 0.109000 0.891000 Zn\n0.234730 0.218516 0.387133 Si\n0.765270 0.781483 0.612867 Si\n0.734730 0.387133 0.218517 Si\n0.265270 0.612866 0.781484 Si\n0.124530 0.140266 0.618364 O\n0.624530 0.618364 0.140267 O\n0.023475 0.616826 0.672401 O\n0.643240 0.963028 0.790387 O\n0.143240 0.790385 0.963030 O\n0.476525 0.327599 0.383174 O\n0.375471 0.381635 0.859734 O\n0.523475 0.672400 0.616827 O\n0.856761 0.209614 0.036971 O\n0.976526 0.383173 0.327600 O\n0.875471 0.859733 0.381636 O\n0.356760 0.036971 0.209614 O\n",
"nsites": 20,
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"elements": [
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],
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"density": 4.111927454491251,
"density_atomic": 0.08750488871302985,
"volume": 228.55865876922047,
"volume_molar": 6.88206207512527,
"formula_full": "Zn4 Si4 O12",
"formula_reduced": "ZnSiO3",
"formula_anonymous": "ABC3",
"energy_above_hull": 1.3963138999999996,
"spacegroup": 15
},
{
"id": "jvasp-116409",
"created_at": "2022-09-04T14:38:31.194122Z",
"updated_at": "2022-09-04T14:38:31.194142Z",
"structure_string": "Zn1 Si1 O1\n1.0\n4.127470 0.000000 -0.000000\n-2.063735 3.574494 0.000000\n0.000000 -0.000000 2.734345\nZn Si O\n1 1 1\ndirect\n0.666667 0.333333 0.000000 Zn\n0.333333 0.666667 0.000000 Si\n0.000000 0.000000 0.000000 O\n",
"nsites": 3,
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"elements": [
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],
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"density_atomic": 0.0743651480906218,
"volume": 40.34147819277093,
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"formula_full": "Zn1 Si1 O1",
"formula_reduced": "ZnSiO",
"formula_anonymous": "ABC",
"energy_above_hull": 1.2284475,
"spacegroup": 187
},
{
"id": "jvasp-35208",
"created_at": "2022-09-04T14:38:05.206272Z",
"updated_at": "2022-09-04T14:38:05.206299Z",
"structure_string": "Zn8 Si4 O16\n1.0\n-5.801410 0.000000 0.000000\n-2.900706 -5.816734 -4.241363\n-2.900706 -5.816734 4.241363\nZn Si O\n8 4 16\ndirect\n0.500001 0.500000 0.500000 Zn\n0.000000 0.000000 0.000000 Zn\n0.750001 0.218796 0.281204 Zn\n0.250002 0.781203 0.718796 Zn\n0.875821 0.624180 0.124180 Zn\n0.624181 0.375820 0.875819 Zn\n0.375821 0.624180 0.124180 Zn\n0.124181 0.375820 0.875819 Zn\n0.879345 0.737884 0.503428 Si\n0.120658 0.262115 0.496571 Si\n0.379343 0.003429 0.237885 Si\n0.620659 0.996571 0.762115 Si\n0.359509 0.368528 0.385600 O\n0.113637 0.631471 0.614400 O\n0.140492 0.114400 0.131472 O\n0.386366 0.885599 0.868528 O\n0.640493 0.631471 0.614400 O\n0.886365 0.368528 0.385600 O\n0.512035 0.230942 0.744991 O\n0.250002 0.535995 0.964004 O\n0.012035 0.244991 0.730942 O\n0.987967 0.755008 0.269058 O\n0.250001 0.035250 0.464749 O\n0.750002 0.964749 0.535250 O\n0.613636 0.114400 0.131472 O\n0.750001 0.464004 0.035996 O\n0.487967 0.769057 0.255009 O\n0.859510 0.885599 0.868528 O\n",
"nsites": 28,
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"elements": [
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],
"chemical_system": "O-Si-Zn",
"density": 5.1721736600344315,
"density_atomic": 0.09781598421299384,
"volume": 286.2517841565662,
"volume_molar": 6.1566019178285,
"formula_full": "Zn8 Si4 O16",
"formula_reduced": "Zn2SiO4",
"formula_anonymous": "AB2C4",
"energy_above_hull": 1.2677033428571425,
"spacegroup": 74
},
{
"id": "jvasp-39732",
"created_at": "2022-09-04T14:37:49.826807Z",
"updated_at": "2022-09-04T14:37:49.826822Z",
"structure_string": "Yb6 Si2 O2\n1.0\n6.521628 -0.000337 -0.000219\n3.257728 5.650040 -0.000626\n3.257704 1.876731 5.329235\nYb Si O\n6 2 2\ndirect\n0.250030 0.269521 0.230478 Yb\n0.750033 0.730478 0.769521 Yb\n0.236652 0.763370 0.256226 Yb\n0.263386 0.243762 0.736637 Yb\n0.763384 0.236638 0.743765 Yb\n0.736651 0.756228 0.263371 Yb\n0.750020 0.249918 0.250081 Si\n0.250019 0.750081 0.749919 Si\n0.000022 0.500000 0.500000 O\n0.500023 1.000000 -0.000001 O\n",
"nsites": 10,
"nelements": 3,
"elements": [
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"Si",
"O"
],
"chemical_system": "O-Si-Yb",
"density": 9.524392025019736,
"density_atomic": 0.05092039278059523,
"volume": 196.38497375870213,
"volume_molar": 11.826579551238106,
"formula_full": "Yb6 Si2 O2",
"formula_reduced": "Yb3SiO",
"formula_anonymous": "ABC3",
"energy_above_hull": 0.3171668399999998,
"spacegroup": 74
}
]
}