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=-volume&page=3584",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-volume&page=3582",
"results": [
{
"id": "jvasp-22688",
"created_at": "2022-09-04T14:36:49.899877Z",
"updated_at": "2022-09-04T14:36:49.899891Z",
"structure_string": "Mg2 H6 Ru1\n1.0\n3.311097 3.311097 0.000000\n-0.000000 3.311097 3.311097\n3.311097 0.000000 3.311097\nMg H Ru\n2 6 1\ndirect\n0.750001 0.750001 0.750001 Mg\n0.250000 0.250000 0.250000 Mg\n0.254383 0.745618 0.745618 H\n0.254383 0.254383 0.745618 H\n0.254383 0.745618 0.254383 H\n0.745618 0.254383 0.254383 H\n0.745618 0.745618 0.254383 H\n0.745618 0.254383 0.745618 H\n0.000000 0.000000 0.000000 Ru\n",
"nsites": 9,
"nelements": 3,
"elements": [
"Mg",
"H",
"Ru"
],
"chemical_system": "H-Mg-Ru",
"density": 3.5617964155605732,
"density_atomic": 0.12396434854046197,
"volume": 72.60151895254303,
"volume_molar": 4.857961850244689,
"formula_full": "Mg2 H6 Ru1",
"formula_reduced": "Mg2H6Ru",
"formula_anonymous": "AB2C6",
"energy_above_hull": 2.358293177777778,
"spacegroup": 225
},
{
"id": "jvasp-116320",
"created_at": "2022-09-04T14:38:42.484261Z",
"updated_at": "2022-09-04T14:38:42.484288Z",
"structure_string": "Mg1 Te1 O1\n1.0\n3.217206 -0.000000 -0.000000\n-0.000000 3.217206 -0.000000\n0.000000 0.000000 7.014346\nMg Te O\n1 1 1\ndirect\n0.000000 0.000000 0.440243 Mg\n0.000000 0.000000 -0.021477 Te\n0.000000 0.000000 0.705687 O\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Mg",
"Te",
"O"
],
"chemical_system": "Mg-O-Te",
"density": 3.840309705903832,
"density_atomic": 0.04132152394863845,
"volume": 72.60138817070057,
"volume_molar": 14.573859297845258,
"formula_full": "Mg1 Te1 O1",
"formula_reduced": "MgTeO",
"formula_anonymous": "ABC",
"energy_above_hull": 0.5464601055555558,
"spacegroup": 99
},
{
"id": "jvasp-69252",
"created_at": "2022-09-04T14:35:56.250982Z",
"updated_at": "2022-09-04T14:35:56.251007Z",
"structure_string": "Ba1 Cu1 Ni2\n1.0\n4.284412 0.000000 0.000000\n0.000000 4.284412 -0.000000\n0.000000 -0.000000 3.954928\nBa Cu Ni\n1 1 2\ndirect\n0.500000 0.500000 0.500000 Ba\n0.000000 0.000000 0.500000 Cu\n0.500000 0.000000 0.000000 Ni\n0.000000 0.500000 0.000000 Ni\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ba",
"Cu",
"Ni"
],
"chemical_system": "Ba-Cu-Ni",
"density": 7.279639073445224,
"density_atomic": 0.05509839596132838,
"volume": 72.59739471921213,
"volume_molar": 10.929793245209405,
"formula_full": "Ba1 Cu1 Ni2",
"formula_reduced": "BaCuNi2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.4715353049999999,
"spacegroup": 123
},
{
"id": "jvasp-64936",
"created_at": "2022-09-04T14:35:46.683403Z",
"updated_at": "2022-09-04T14:35:46.683427Z",
"structure_string": "Hf1 Be1 Co4\n1.0\n0.000000 3.311007 3.311007\n3.311007 0.000000 3.311007\n3.311007 3.311007 -0.000000\nHf Be Co\n1 1 4\ndirect\n0.750001 0.750001 0.750001 Hf\n0.000000 0.000000 0.000000 Be\n0.373902 0.373902 0.373902 Co\n0.373902 0.878296 0.373902 Co\n0.373902 0.373902 0.878296 Co\n0.878296 0.373902 0.373902 Co\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Hf",
"Be",
"Co"
],
"chemical_system": "Be-Co-Hf",
"density": 9.681002697513893,
"density_atomic": 0.08264963842356066,
"volume": 72.59559889725543,
"volume_molar": 7.286348585262882,
"formula_full": "Hf1 Be1 Co4",
"formula_reduced": "HfBeCo4",
"formula_anonymous": "ABC4",
"energy_above_hull": 3.755102116666667,
"spacegroup": 216
},
{
"id": "jvasp-17653",
"created_at": "2022-09-04T14:37:31.868634Z",
"updated_at": "2022-09-04T14:37:31.868662Z",
"structure_string": "Li1 In2 Pt1\n1.0\n4.055078 0.000000 2.341201\n1.351693 3.823165 2.341201\n-0.000000 0.000000 4.682401\nLi In Pt\n1 2 1\ndirect\n0.000000 0.000000 0.000000 Li\n0.250000 0.250000 0.250000 In\n0.750000 0.749999 0.750000 In\n0.500000 0.499999 0.500000 Pt\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Li",
"In",
"Pt"
],
"chemical_system": "In-Li-Pt",
"density": 9.874180277560653,
"density_atomic": 0.05510222470099037,
"volume": 72.59235033986036,
"volume_molar": 10.929033796146824,
"formula_full": "Li1 In2 Pt1",
"formula_reduced": "LiIn2Pt",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.460655335,
"spacegroup": 225
},
{
"id": "jvasp-114029",
"created_at": "2022-09-04T14:38:49.649401Z",
"updated_at": "2022-09-04T14:38:49.649430Z",
"structure_string": "S1 F2\n1.0\n5.239258 0.000000 0.000000\n0.000000 3.848571 0.000000\n0.000000 0.000000 3.599809\nS F\n1 2\ndirect\n0.000000 0.276051 0.000000 S\n0.235469 -0.002026 0.000000 F\n0.764531 -0.002026 0.000000 F\n",
"nsites": 3,
"nelements": 2,
"elements": [
"S",
"F"
],
"chemical_system": "F-S",
"density": 1.6028086639889383,
"density_atomic": 0.04133067594967651,
"volume": 72.58531178277235,
"volume_molar": 14.570632155478053,
"formula_full": "S1 F2",
"formula_reduced": "SF2",
"formula_anonymous": "AB2",
"energy_above_hull": 0.2045533333333332,
"spacegroup": 25
},
{
"id": "jvasp-107525",
"created_at": "2022-09-04T14:36:55.458663Z",
"updated_at": "2022-09-04T14:36:55.458685Z",
"structure_string": "Sn1 Sb1\n1.0\n4.105312 -0.092418 1.420612\n0.982207 3.987154 1.420612\n-0.120721 -0.092418 4.342482\nSn Sb\n1 1\ndirect\n0.347405 0.347404 0.347405 Sn\n0.652596 0.652594 0.652595 Sb\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Sn",
"Sb"
],
"chemical_system": "Sb-Sn",
"density": 5.501361611339383,
"density_atomic": 0.027554351067987846,
"volume": 72.58381789014673,
"volume_molar": 21.85549841163349,
"formula_full": "Sn1 Sb1",
"formula_reduced": "SnSb",
"formula_anonymous": "AB",
"energy_above_hull": 0.7350539000000003,
"spacegroup": 160
},
{
"id": "jvasp-39824",
"created_at": "2022-09-04T14:37:41.366649Z",
"updated_at": "2022-09-04T14:37:41.366661Z",
"structure_string": "Ti3 Tl1\n1.0\n-2.029995 2.029995 4.403230\n2.029995 -2.029995 4.403230\n2.029995 2.029995 -4.403230\nTi Tl\n3 1\ndirect\n0.749999 0.250000 0.499999 Ti\n0.250000 0.749999 0.499999 Ti\n0.499999 0.499999 0.000000 Ti\n0.000000 0.000000 0.000000 Tl\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Ti",
"Tl"
],
"chemical_system": "Ti-Tl",
"density": 7.961363417137082,
"density_atomic": 0.05511105087911458,
"volume": 72.58072448616433,
"volume_molar": 10.927283482961506,
"formula_full": "Ti3 Tl1",
"formula_reduced": "Ti3Tl",
"formula_anonymous": "AB3",
"energy_above_hull": 2.7092444,
"spacegroup": 139
},
{
"id": "jvasp-78382",
"created_at": "2022-09-04T14:37:52.380402Z",
"updated_at": "2022-09-04T14:37:52.380426Z",
"structure_string": "K1 P1\n1.0\n0.000000 -4.676843 0.000000\n3.504766 -2.338421 -2.046650\n3.091621 -2.338421 2.622611\nK P\n1 1\ndirect\n0.000000 0.000000 0.000000 K\n0.499999 0.500000 0.500000 P\n",
"nsites": 2,
"nelements": 2,
"elements": [
"K",
"P"
],
"chemical_system": "K-P",
"density": 1.6031514824395143,
"density_atomic": 0.027555643760532635,
"volume": 72.58041283232721,
"volume_molar": 21.85447312475924,
"formula_full": "K1 P1",
"formula_reduced": "KP",
"formula_anonymous": "AB",
"energy_above_hull": 0.9285335,
"spacegroup": 225
},
{
"id": "jvasp-115453",
"created_at": "2022-09-04T14:38:46.360562Z",
"updated_at": "2022-09-04T14:38:46.360591Z",
"structure_string": "Mg2 Au1 O3\n1.0\n-1.519143 2.143628 5.571584\n1.519143 -2.143628 5.571584\n1.519143 2.143628 -5.571584\nMg Au O\n2 1 3\ndirect\n0.851372 0.351371 0.500001 Mg\n0.148629 0.648627 0.499998 Mg\n0.500001 -0.000000 0.500001 Au\n0.000000 0.000000 0.000000 O\n0.319454 0.819452 0.499998 O\n0.680547 0.180546 0.500001 O\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Mg",
"Au",
"O"
],
"chemical_system": "Au-Mg-O",
"density": 6.717088548676705,
"density_atomic": 0.08267315251092504,
"volume": 72.57495109076814,
"volume_molar": 7.28427618531202,
"formula_full": "Mg2 Au1 O3",
"formula_reduced": "Mg2AuO3",
"formula_anonymous": "AB2C3",
"energy_above_hull": 0.8448026949999998,
"spacegroup": 71
},
{
"id": "jvasp-38843",
"created_at": "2022-09-04T14:37:49.566077Z",
"updated_at": "2022-09-04T14:37:49.566097Z",
"structure_string": "Zr1 In1 Pd2\n1.0\n4.681414 0.002489 0.001642\n2.338200 4.056542 0.001479\n2.339003 1.353579 3.823849\nZr In Pd\n1 1 2\ndirect\n0.750010 0.750011 0.749993 Zr\n0.249990 0.249999 0.250007 In\n0.999995 0.000012 0.000053 Pd\n0.500002 0.499977 0.499946 Pd\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Zr",
"In",
"Pd"
],
"chemical_system": "In-Pd-Zr",
"density": 9.584253622162231,
"density_atomic": 0.05511597482073408,
"volume": 72.57424028169851,
"volume_molar": 10.926307263161261,
"formula_full": "Zr1 In1 Pd2",
"formula_reduced": "ZrInPd2",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.6118364675000003,
"spacegroup": 225
},
{
"id": "jvasp-64978",
"created_at": "2022-09-04T14:35:52.954974Z",
"updated_at": "2022-09-04T14:35:52.955004Z",
"structure_string": "Na1 Ca1 Be2\n1.0\n-2.340883 2.340883 3.310774\n2.340883 -2.340883 3.310774\n2.340883 2.340883 -3.310774\nNa Ca Be\n1 1 2\ndirect\n0.749999 0.250000 0.499999 Na\n0.499999 0.499999 0.000000 Ca\n0.000000 0.000000 0.000000 Be\n0.250000 0.749999 0.499999 Be\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Na",
"Ca",
"Be"
],
"chemical_system": "Be-Ca-Na",
"density": 1.855576570553027,
"density_atomic": 0.055120233495922065,
"volume": 72.5686330827305,
"volume_molar": 10.925463079624896,
"formula_full": "Na1 Ca1 Be2",
"formula_reduced": "NaCaBe2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.76897873125,
"spacegroup": 216
}
]
}