HTTP 200 OK
Allow: GET, HEAD, OPTIONS
Content-Type: application/json
Vary: Accept
{
"count": 55712,
"next": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-nelements&page=4541",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-nelements&page=4539",
"results": [
{
"id": "jvasp-36367",
"created_at": "2022-09-04T14:37:15.839193Z",
"updated_at": "2022-09-04T14:37:15.839224Z",
"structure_string": "Re1 N1\n1.0\n1.398830 -2.422845 0.000000\n1.398830 2.422845 0.000000\n-0.000000 -0.000000 3.031706\nRe N\n1 1\ndirect\n0.000000 0.000000 0.000000 Re\n0.666667 0.333333 0.500001 N\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Re",
"N"
],
"chemical_system": "N-Re",
"density": 16.178387786548836,
"density_atomic": 0.09732453728604101,
"volume": 20.549802298282845,
"volume_molar": 6.18769010152154,
"formula_full": "Re1 N1",
"formula_reduced": "ReN",
"formula_anonymous": "AB",
"energy_above_hull": 4.296955625,
"spacegroup": 187
},
{
"id": "jvasp-40636",
"created_at": "2022-09-04T14:37:26.973476Z",
"updated_at": "2022-09-04T14:37:26.973501Z",
"structure_string": "Si4 O10\n1.0\n-3.008464 6.344778 2.516483\n3.008464 -6.344778 2.516483\n3.008464 6.344778 -2.516483\nSi O\n4 10\ndirect\n0.566606 0.052919 0.719018 Si\n0.333900 0.847586 0.280981 Si\n0.833901 0.052919 0.986313 Si\n0.066605 0.847586 0.013686 Si\n0.497559 0.997558 0.499999 O\n0.997558 0.997558 0.000000 O\n0.278585 0.828673 0.817065 O\n0.011607 0.461518 0.182934 O\n0.511607 0.828673 0.050088 O\n0.778586 0.461518 0.949911 O\n0.722806 0.918625 0.580793 O\n0.337834 0.142013 0.419206 O\n0.837833 0.918625 0.695820 O\n0.222806 0.142013 0.304180 O\n",
"nsites": 14,
"nelements": 2,
"elements": [
"Si",
"O"
],
"chemical_system": "O-Si",
"density": 2.353633894357978,
"density_atomic": 0.07286396385318314,
"volume": 192.1388744127238,
"volume_molar": 8.26490962272418,
"formula_full": "Si4 O10",
"formula_reduced": "Si2O5",
"formula_anonymous": "A2B5",
"energy_above_hull": 2.6731521,
"spacegroup": 46
},
{
"id": "jvasp-17234",
"created_at": "2022-09-04T14:37:44.735380Z",
"updated_at": "2022-09-04T14:37:44.735396Z",
"structure_string": "Yb1 Ga2\n1.0\n2.199405 -3.809480 -0.000000\n2.199405 3.809480 0.000000\n-0.000000 -0.000000 3.673354\nYb Ga\n1 2\ndirect\n0.000000 0.000000 0.000000 Yb\n0.666666 0.333332 0.499999 Ga\n0.333332 0.666666 0.499999 Ga\n",
"nsites": 3,
"nelements": 2,
"elements": [
"Yb",
"Ga"
],
"chemical_system": "Ga-Yb",
"density": 8.429774895604316,
"density_atomic": 0.04873686278488018,
"volume": 61.55504947541886,
"volume_molar": 12.356439080991217,
"formula_full": "Yb1 Ga2",
"formula_reduced": "YbGa2",
"formula_anonymous": "AB2",
"energy_above_hull": 0.0251033333333333,
"spacegroup": 191
},
{
"id": "jvasp-36348",
"created_at": "2022-09-04T14:37:27.904946Z",
"updated_at": "2022-09-04T14:37:27.904975Z",
"structure_string": "Pd1 C1\n1.0\n2.354388 2.354388 -0.000000\n2.354388 0.000000 -2.354388\n0.000000 2.354388 -2.354388\nPd C\n1 1\ndirect\n0.000000 0.000000 0.000000 Pd\n0.750001 0.750001 0.750001 C\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Pd",
"C"
],
"chemical_system": "C-Pd",
"density": 7.534410726195534,
"density_atomic": 0.07662418942467344,
"volume": 26.101418038048283,
"volume_molar": 7.859320673036491,
"formula_full": "Pd1 C1",
"formula_reduced": "PdC",
"formula_anonymous": "AB",
"energy_above_hull": 3.15438785,
"spacegroup": 216
},
{
"id": "jvasp-10463",
"created_at": "2022-09-04T14:37:15.606894Z",
"updated_at": "2022-09-04T14:37:15.606913Z",
"structure_string": "Ba10 Sb8\n1.0\n8.104133 -0.000000 -4.118959\n-0.000000 9.133181 -0.000000\n-0.011485 0.000000 10.009406\nBa Sb\n10 8\ndirect\n0.500000 0.500000 -0.000000 Ba\n0.475577 0.834081 0.290909 Ba\n0.684668 0.665919 0.709092 Ba\n0.975576 0.665919 0.290909 Ba\n0.184668 0.834081 0.709092 Ba\n0.524424 0.165919 0.709092 Ba\n0.315332 0.334081 0.290909 Ba\n0.000000 0.000000 0.000000 Ba\n0.024424 0.334081 0.709092 Ba\n0.815332 0.165919 0.290909 Ba\n0.699561 0.500000 0.399124 Sb\n0.800439 0.000000 0.600877 Sb\n0.300439 0.500000 0.600877 Sb\n0.199561 0.000000 0.399124 Sb\n0.114901 0.614800 -0.000000 Sb\n0.614901 0.885200 -0.000000 Sb\n0.385098 0.114800 -0.000000 Sb\n0.885098 0.385200 -0.000000 Sb\n",
"nsites": 18,
"nelements": 2,
"elements": [
"Ba",
"Sb"
],
"chemical_system": "Ba-Sb",
"density": 5.264333127698285,
"density_atomic": 0.02431022182643174,
"volume": 740.4292782071271,
"volume_molar": 24.772051867714,
"formula_full": "Ba10 Sb8",
"formula_reduced": "Ba5Sb4",
"formula_anonymous": "A4B5",
"energy_above_hull": 0.5599060277777778,
"spacegroup": 64
},
{
"id": "jvasp-51343",
"created_at": "2022-09-04T14:37:07.176914Z",
"updated_at": "2022-09-04T14:37:07.176940Z",
"structure_string": "H2 Br2\n1.0\n2.606428 0.000000 3.099723\n0.000000 5.421191 0.000000\n-2.606428 0.000000 3.099723\nH Br\n2 2\ndirect\n0.939981 0.684687 0.060018 H\n0.060018 0.184687 0.939981 H\n0.741615 0.494313 0.258384 Br\n0.258384 0.994313 0.741615 Br\n",
"nsites": 4,
"nelements": 2,
"elements": [
"H",
"Br"
],
"chemical_system": "Br-H",
"density": 3.0675975679648047,
"density_atomic": 0.04566323426604719,
"volume": 87.59782490865288,
"volume_molar": 13.188160796743546,
"formula_full": "H2 Br2",
"formula_reduced": "HBr",
"formula_anonymous": "AB",
"energy_above_hull": 0.7354020525000001,
"spacegroup": 36
},
{
"id": "jvasp-78533",
"created_at": "2022-09-04T14:37:10.613034Z",
"updated_at": "2022-09-04T14:37:10.613069Z",
"structure_string": "La1 Pd2\n1.0\n3.989079 -0.000000 -0.000000\n-0.000000 3.989079 -0.000000\n-1.994539 -1.994539 4.460376\nLa Pd\n1 2\ndirect\n0.000000 0.000000 0.000000 La\n0.250000 0.750000 0.500000 Pd\n0.750000 0.250000 0.500000 Pd\n",
"nsites": 3,
"nelements": 2,
"elements": [
"La",
"Pd"
],
"chemical_system": "La-Pd",
"density": 8.229261551408337,
"density_atomic": 0.04226730035547843,
"volume": 70.97685385083172,
"volume_molar": 14.247753486388556,
"formula_full": "La1 Pd2",
"formula_reduced": "LaPd2",
"formula_anonymous": "AB2",
"energy_above_hull": 1.3362988000000002,
"spacegroup": 139
},
{
"id": "jvasp-10188",
"created_at": "2022-09-04T14:37:10.598851Z",
"updated_at": "2022-09-04T14:37:10.598877Z",
"structure_string": "Cd2 P8\n1.0\n0.000000 5.316646 0.023512\n5.207470 0.000000 0.000000\n0.000000 -1.252357 -7.621710\nCd P\n2 8\ndirect\n-0.000000 0.500000 0.500000 Cd\n0.000000 0.000000 0.000000 Cd\n0.397517 0.604225 0.099087 P\n0.602483 0.104225 0.400913 P\n0.260320 0.290017 0.251873 P\n0.739680 0.790017 0.248127 P\n0.739680 0.709983 0.748127 P\n0.260320 0.209983 0.751873 P\n0.397517 0.895775 0.599087 P\n0.602483 0.395775 0.900913 P\n",
"nsites": 10,
"nelements": 2,
"elements": [
"Cd",
"P"
],
"chemical_system": "Cd-P",
"density": 3.721797032646912,
"density_atomic": 0.04742406258365325,
"volume": 210.86341943734976,
"volume_molar": 12.698491929866401,
"formula_full": "Cd2 P8",
"formula_reduced": "CdP4",
"formula_anonymous": "AB4",
"energy_above_hull": 2.2815967000000006,
"spacegroup": 14
},
{
"id": "jvasp-347",
"created_at": "2022-09-04T14:37:26.983527Z",
"updated_at": "2022-09-04T14:37:26.983547Z",
"structure_string": "W1 S2\n1.0\n3.101395 0.001855 5.732182\n1.452737 2.740112 5.732182\n0.003081 0.001855 6.517404\nW S\n1 2\ndirect\n0.000662 0.000662 0.000662 W\n0.417942 0.417944 0.417942 S\n0.250095 0.250096 0.250095 S\n",
"nsites": 3,
"nelements": 2,
"elements": [
"W",
"S"
],
"chemical_system": "S-W",
"density": 7.445657815234243,
"density_atomic": 0.054247045323583515,
"volume": 55.30255117315618,
"volume_molar": 11.10132491839499,
"formula_full": "W1 S2",
"formula_reduced": "WS2",
"formula_anonymous": "AB2",
"energy_above_hull": 3.2208766666666664,
"spacegroup": 160
},
{
"id": "jvasp-12886",
"created_at": "2022-09-04T14:37:07.219454Z",
"updated_at": "2022-09-04T14:37:07.219480Z",
"structure_string": "Zr6 I12\n1.0\n8.667909 -0.016865 -2.686659\n-3.640959 7.866154 -2.686657\n-0.010800 -0.016867 9.074728\nZr I\n6 12\ndirect\n0.907773 0.969660 0.723275 Zr\n0.969661 0.723274 0.907773 Zr\n0.723275 0.907773 0.969661 Zr\n0.092226 0.030339 0.276724 Zr\n0.030339 0.276724 0.092226 Zr\n0.276724 0.092226 0.030339 Zr\n0.770652 0.921948 0.311614 I\n0.688386 0.229347 0.078050 I\n0.078050 0.688385 0.229347 I\n0.229347 0.078050 0.688386 I\n0.545117 0.850561 0.621186 I\n0.454882 0.149437 0.378814 I\n0.621186 0.545117 0.850562 I\n0.921949 0.311613 0.770652 I\n0.149438 0.378813 0.454882 I\n0.378813 0.454882 0.149438 I\n0.850562 0.621185 0.545117 I\n0.311614 0.770652 0.921949 I\n",
"nsites": 18,
"nelements": 2,
"elements": [
"Zr",
"I"
],
"chemical_system": "I-Zr",
"density": 5.567942018290443,
"density_atomic": 0.029154547321700162,
"volume": 617.3993991874582,
"volume_molar": 20.655922705812795,
"formula_full": "Zr6 I12",
"formula_reduced": "ZrI2",
"formula_anonymous": "AB2",
"energy_above_hull": 0.8010623500000003,
"spacegroup": 148
},
{
"id": "jvasp-38942",
"created_at": "2022-09-04T14:37:27.914362Z",
"updated_at": "2022-09-04T14:37:27.914385Z",
"structure_string": "Mg3 Cr1\n1.0\n-2.209607 2.209607 4.159850\n2.209607 -2.209607 4.159850\n2.209607 2.209607 -4.159850\nMg Cr\n3 1\ndirect\n0.500000 0.500000 0.000000 Mg\n0.750002 0.250000 0.500002 Mg\n0.250000 0.750002 0.500002 Mg\n0.000000 0.000000 0.000000 Cr\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Mg",
"Cr"
],
"chemical_system": "Cr-Mg",
"density": 2.5531856461359936,
"density_atomic": 0.04923707613736809,
"volume": 81.23959247377469,
"volume_molar": 12.230906529052696,
"formula_full": "Mg3 Cr1",
"formula_reduced": "Mg3Cr",
"formula_anonymous": "AB3",
"energy_above_hull": 0.7618332000000003,
"spacegroup": 139
},
{
"id": "jvasp-20193",
"created_at": "2022-09-04T14:37:32.798188Z",
"updated_at": "2022-09-04T14:37:32.798220Z",
"structure_string": "Tm16 O24\n1.0\n8.523550 -0.000000 -3.013531\n-4.261775 7.381610 -3.013531\n0.000000 0.000000 9.040591\nTm O\n16 24\ndirect\n0.250000 0.717068 0.467067 Tm\n0.500000 0.500000 0.500000 Tm\n-0.000000 -0.000000 0.500000 Tm\n0.500000 0.000000 0.000000 Tm\n-0.000000 0.500000 -0.000000 Tm\n0.250000 0.217068 0.967067 Tm\n0.532932 0.750000 0.282932 Tm\n0.282932 0.532932 0.750000 Tm\n0.967067 0.250000 0.217068 Tm\n0.750000 0.282932 0.532932 Tm\n0.750000 0.782932 0.032932 Tm\n0.717067 0.467068 0.250000 Tm\n0.467067 0.250000 0.717068 Tm\n0.782932 0.032932 0.750000 Tm\n0.217067 0.967068 0.250000 Tm\n0.032932 0.750000 0.782932 Tm\n0.228764 0.456352 0.467991 O\n0.032009 0.488361 0.760773 O\n0.227588 0.271236 0.739227 O\n0.272412 0.011639 0.043648 O\n0.532009 0.771236 0.543648 O\n0.271235 0.739227 0.227588 O\n0.988361 0.956352 0.727588 O\n0.260773 0.772412 0.728764 O\n0.511639 0.239227 0.967991 O\n0.956352 0.727588 0.988361 O\n0.728764 0.260773 0.772412 O\n0.239226 0.967991 0.511639 O\n0.543647 0.532009 0.771236 O\n0.760773 0.032009 0.488361 O\n0.771235 0.543648 0.532009 O\n0.772412 0.728764 0.260773 O\n0.967991 0.511639 0.239227 O\n0.467991 0.228764 0.456352 O\n0.011639 0.043648 0.272412 O\n0.739227 0.227588 0.271236 O\n0.488361 0.760773 0.032009 O\n0.043648 0.272412 0.011639 O\n0.727587 0.988361 0.956352 O\n0.456352 0.467991 0.228764 O\n",
"nsites": 40,
"nelements": 2,
"elements": [
"Tm",
"O"
],
"chemical_system": "O-Tm",
"density": 9.011723626799622,
"density_atomic": 0.07032205608969173,
"volume": 568.8115823715721,
"volume_molar": 8.563658537399855,
"formula_full": "Tm16 O24",
"formula_reduced": "Tm2O3",
"formula_anonymous": "A2B3",
"energy_above_hull": 1.3295397999999998,
"spacegroup": 206
}
]
}