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=id&page=217",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=id&page=215",
"results": [
{
"id": "jvasp-103379",
"created_at": "2022-09-04T14:36:34.107193Z",
"updated_at": "2022-09-04T14:36:34.107217Z",
"structure_string": "Tm1 In1 Co4\n1.0\n4.283531 -0.000000 2.473098\n1.427844 4.038552 2.473098\n-0.000000 -0.000000 4.946195\nTm In Co\n1 1 4\ndirect\n0.749999 0.750000 0.750002 Tm\n0.000000 0.000000 0.000000 In\n0.374587 0.374588 0.374589 Co\n0.876235 0.374588 0.374589 Co\n0.374587 0.876235 0.374589 Co\n0.374587 0.374588 0.876237 Co\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Tm",
"In",
"Co"
],
"chemical_system": "Co-In-Tm",
"density": 10.081456336645354,
"density_atomic": 0.07012169781389027,
"volume": 85.56552660667995,
"volume_molar": 8.588127423815864,
"formula_full": "Tm1 In1 Co4",
"formula_reduced": "TmInCo4",
"formula_anonymous": "ABC4",
"energy_above_hull": 2.5574779699999994,
"spacegroup": 216
},
{
"id": "jvasp-103382",
"created_at": "2022-09-04T14:36:42.066245Z",
"updated_at": "2022-09-04T14:36:42.066264Z",
"structure_string": "Lu4 Sn2 Au4\n1.0\n8.162410 0.000000 -0.000000\n-0.000000 8.162410 0.000000\n-0.000000 0.000000 3.520468\nLu Sn Au\n4 2 4\ndirect\n0.840080 0.340080 0.500000 Lu\n0.159920 0.659920 0.500000 Lu\n0.340080 0.159920 0.500000 Lu\n0.659920 0.840080 0.500000 Lu\n0.000000 0.000000 0.500000 Sn\n0.500000 0.500000 0.500000 Sn\n0.632256 0.132256 0.000000 Au\n0.367744 0.867744 0.000000 Au\n0.132256 0.367744 0.000000 Au\n0.867744 0.632256 0.000000 Au\n",
"nsites": 10,
"nelements": 3,
"elements": [
"Lu",
"Sn",
"Au"
],
"chemical_system": "Au-Lu-Sn",
"density": 12.213491202981489,
"density_atomic": 0.04263465838622426,
"volume": 234.55095873903176,
"volume_molar": 14.124988889194013,
"formula_full": "Lu4 Sn2 Au4",
"formula_reduced": "Lu2SnAu2",
"formula_anonymous": "AB2C2",
"energy_above_hull": 0.707145668,
"spacegroup": 127
},
{
"id": "jvasp-103383",
"created_at": "2022-09-04T14:36:35.160545Z",
"updated_at": "2022-09-04T14:36:35.160562Z",
"structure_string": "Zr1 Ti1 C2\n1.0\n3.080207 0.001735 4.605188\n1.399429 2.743952 4.605188\n0.002830 0.001735 5.540346\nZr Ti C\n1 1 2\ndirect\n0.000000 0.000000 0.000000 Zr\n0.500002 0.499998 0.500001 Ti\n0.244654 0.244652 0.244654 C\n0.755349 0.755343 0.755348 C\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Zr",
"Ti",
"C"
],
"chemical_system": "C-Ti-Zr",
"density": 5.791938363270267,
"density_atomic": 0.0855357854066553,
"volume": 46.76405297482393,
"volume_molar": 7.040492738062161,
"formula_full": "Zr1 Ti1 C2",
"formula_reduced": "ZrTiC2",
"formula_anonymous": "ABC2",
"energy_above_hull": 4.821935708333333,
"spacegroup": 166
},
{
"id": "jvasp-103386",
"created_at": "2022-09-04T14:36:35.304690Z",
"updated_at": "2022-09-04T14:36:35.304709Z",
"structure_string": "Zr1 Nb1\n1.0\n2.981838 -0.005952 0.000000\n-1.006990 2.806664 0.000000\n0.000000 0.000000 4.830601\nZr Nb\n1 1\ndirect\n0.500000 0.500000 0.500000 Zr\n0.000000 0.000000 0.000000 Nb\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Zr",
"Nb"
],
"chemical_system": "Nb-Zr",
"density": 7.568504075370155,
"density_atomic": 0.04950687322783315,
"volume": 40.3984309571703,
"volume_molar": 12.164251885361052,
"formula_full": "Zr1 Nb1",
"formula_reduced": "ZrNb",
"formula_anonymous": "AB",
"energy_above_hull": 3.31233195,
"spacegroup": 65
},
{
"id": "jvasp-10339",
"created_at": "2022-09-04T14:37:28.654431Z",
"updated_at": "2022-09-04T14:37:28.654452Z",
"structure_string": "Zn2 Mo4 O10\n1.0\n3.729885 -0.000000 0.000000\n-1.864942 5.348269 -0.000000\n-0.000000 -0.000000 11.293585\nZn Mo O\n2 4 10\ndirect\n0.889625 0.779245 0.750000 Zn\n0.110378 0.220756 0.250000 Zn\n0.188054 0.376107 0.600741 Mo\n0.811948 0.623894 0.399258 Mo\n0.811948 0.623894 0.100742 Mo\n0.188054 0.376107 0.899259 Mo\n0.694232 0.388464 0.250000 O\n0.305770 0.611537 0.750000 O\n0.239691 0.479379 0.075778 O\n0.760313 0.520622 0.924221 O\n0.760313 0.520622 0.575778 O\n0.239691 0.479379 0.424221 O\n0.027942 0.055883 0.625817 O\n0.972060 0.944117 0.374182 O\n0.027942 0.055883 0.874182 O\n0.972060 0.944117 0.125818 O\n",
"nsites": 16,
"nelements": 3,
"elements": [
"Zn",
"Mo",
"O"
],
"chemical_system": "Mo-O-Zn",
"density": 4.972066157740484,
"density_atomic": 0.07101980462940778,
"volume": 225.28927083776773,
"volume_molar": 8.479523129392502,
"formula_full": "Zn2 Mo4 O10",
"formula_reduced": "ZnMo2O5",
"formula_anonymous": "AB2C5",
"energy_above_hull": 3.0686774625,
"spacegroup": 63
},
{
"id": "jvasp-103393",
"created_at": "2022-09-04T14:36:35.126805Z",
"updated_at": "2022-09-04T14:36:35.126828Z",
"structure_string": "Zr2 Al3 Ni1\n1.0\n4.540647 -0.011384 2.412835\n1.445127 4.304558 2.412835\n-0.015873 -0.011384 5.141888\nZr Al Ni\n2 3 1\ndirect\n0.625337 0.625338 0.625335 Zr\n0.374664 0.374664 0.374662 Zr\n0.000000 0.500000 -0.000001 Al\n0.500000 0.000001 -0.000001 Al\n0.000000 0.000001 0.500000 Al\n0.000000 0.000000 0.000000 Ni\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Zr",
"Al",
"Ni"
],
"chemical_system": "Al-Ni-Zr",
"density": 5.304044880723432,
"density_atomic": 0.05950280977106419,
"volume": 100.83557437177966,
"volume_molar": 10.120767041371762,
"formula_full": "Zr2 Al3 Ni1",
"formula_reduced": "Zr2Al3Ni",
"formula_anonymous": "AB2C3",
"energy_above_hull": 2.6262333000000004,
"spacegroup": 166
},
{
"id": "jvasp-103397",
"created_at": "2022-09-04T14:38:39.807912Z",
"updated_at": "2022-09-04T14:38:39.807934Z",
"structure_string": "Y1 Mg1 Co2 Ni2\n1.0\n4.311144 0.054279 -2.460965\n-1.384512 4.003955 -2.587804\n0.007039 -0.054279 4.964097\nY Mg Co Ni\n1 1 2 2\ndirect\n0.998914 0.998916 0.000002 Y\n0.255172 0.755172 0.500002 Mg\n0.623471 0.873322 0.249852 Co\n0.623471 0.373621 0.750151 Co\n0.128213 0.374487 0.753728 Ni\n0.620760 0.374487 0.246275 Ni\n",
"nsites": 6,
"nelements": 4,
"elements": [
"Y",
"Mg",
"Co",
"Ni"
],
"chemical_system": "Co-Mg-Ni-Y",
"density": 6.780440817771908,
"density_atomic": 0.07030757440609864,
"volume": 85.33931159883034,
"volume_molar": 8.565422446827617,
"formula_full": "Y1 Mg1 Co2 Ni2",
"formula_reduced": "YMg(CoNi)2",
"formula_anonymous": "ABC2D2",
"energy_above_hull": 1.9293418500000004,
"spacegroup": 44
},
{
"id": "jvasp-103400",
"created_at": "2022-09-04T14:36:35.364915Z",
"updated_at": "2022-09-04T14:36:35.364924Z",
"structure_string": "V1 Au1\n1.0\n2.693330 0.005730 4.082152\n1.229589 2.396284 4.082152\n0.009359 0.005730 4.890594\nV Au\n1 1\ndirect\n0.500001 0.499999 0.499999 V\n0.000000 0.000000 0.000000 Au\n",
"nsites": 2,
"nelements": 2,
"elements": [
"V",
"Au"
],
"chemical_system": "Au-V",
"density": 13.108642716149317,
"density_atomic": 0.06368658507559963,
"volume": 31.40378774628731,
"volume_molar": 9.455901510265267,
"formula_full": "V1 Au1",
"formula_reduced": "VAu",
"formula_anonymous": "AB",
"energy_above_hull": 1.6911958850000002,
"spacegroup": 166
},
{
"id": "jvasp-103401",
"created_at": "2022-09-04T14:36:47.599562Z",
"updated_at": "2022-09-04T14:36:47.599584Z",
"structure_string": "V6 Ge1 Os1\n1.0\n4.770994 0.000000 0.000000\n-0.000000 4.770994 -0.000000\n-0.000000 -0.000000 4.770994\nV Ge Os\n6 1 1\ndirect\n0.000000 0.500000 0.747197 V\n0.500000 0.252803 0.000000 V\n0.747197 0.000000 0.500000 V\n0.000000 0.500000 0.252803 V\n0.500000 0.747197 0.000000 V\n0.252803 0.000000 0.500000 V\n0.000000 0.000000 0.000000 Ge\n0.500000 0.500000 0.500000 Os\n",
"nsites": 8,
"nelements": 3,
"elements": [
"V",
"Ge",
"Os"
],
"chemical_system": "Ge-Os-V",
"density": 8.692955766490838,
"density_atomic": 0.0736653702189058,
"volume": 108.59919628757727,
"volume_molar": 8.174995580833247,
"formula_full": "V6 Ge1 Os1",
"formula_reduced": "V6GeOs",
"formula_anonymous": "ABC6",
"energy_above_hull": 4.752604518749999,
"spacegroup": 200
},
{
"id": "jvasp-103403",
"created_at": "2022-09-04T14:36:48.872405Z",
"updated_at": "2022-09-04T14:36:48.872430Z",
"structure_string": "Tl1 Bi1 F4\n1.0\n4.009621 -0.000000 0.000000\n-0.000000 4.009621 -0.000000\n0.000000 -0.000000 6.652472\nTl Bi F\n1 1 4\ndirect\n0.000000 0.000000 0.000000 Tl\n0.500000 0.500000 0.500000 Bi\n0.500000 0.000000 0.698833 F\n0.000000 0.500000 0.301166 F\n0.500000 0.000000 0.301166 F\n0.000000 0.500000 0.698833 F\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Tl",
"Bi",
"F"
],
"chemical_system": "Bi-F-Tl",
"density": 7.597758359168795,
"density_atomic": 0.05609983026928987,
"volume": 106.95219524192599,
"volume_molar": 10.734686238964676,
"formula_full": "Tl1 Bi1 F4",
"formula_reduced": "TlBiF4",
"formula_anonymous": "ABC4",
"energy_above_hull": 0.0045449999999996,
"spacegroup": 123
},
{
"id": "jvasp-103404",
"created_at": "2022-09-04T14:36:49.812650Z",
"updated_at": "2022-09-04T14:36:49.812670Z",
"structure_string": "Tl2 Bi1 Sb1 Te4\n1.0\n4.532570 0.000000 0.000000\n0.000000 7.459808 2.452505\n0.000000 0.020954 8.314513\nTl Bi Sb Te\n2 1 1 4\ndirect\n0.000000 0.500000 0.500000 Tl\n0.500000 -0.000000 0.500000 Tl\n0.000000 0.000000 0.000000 Bi\n0.500000 0.500000 -0.000000 Sb\n0.500000 0.754071 0.224407 Te\n0.000000 0.263808 0.221764 Te\n0.500000 0.245929 0.775592 Te\n0.000000 0.736192 0.778235 Te\n",
"nsites": 8,
"nelements": 4,
"elements": [
"Tl",
"Bi",
"Sb",
"Te"
],
"chemical_system": "Bi-Sb-Te-Tl",
"density": 7.38886598964066,
"density_atomic": 0.02848006519638335,
"volume": 280.8982333725806,
"volume_molar": 21.145108757562625,
"formula_full": "Tl2 Bi1 Sb1 Te4",
"formula_reduced": "Tl2BiSbTe4",
"formula_anonymous": "ABC2D4",
"energy_above_hull": 0.6763183333333335,
"spacegroup": 10
},
{
"id": "jvasp-103405",
"created_at": "2022-09-04T14:36:50.714098Z",
"updated_at": "2022-09-04T14:36:50.714126Z",
"structure_string": "Tl1 In2 Ga1 Te4\n1.0\n6.771950 -0.034231 -1.792478\n-2.721798 5.457430 -3.446987\n-0.028656 0.034231 7.005102\nTl In Ga Te\n1 2 1 4\ndirect\n-0.000001 0.500000 0.499999 Tl\n0.500000 0.500000 -0.000000 In\n0.000000 0.000000 0.000000 In\n0.500000 0.000000 0.500000 Ga\n0.852886 0.409065 0.909972 Te\n0.147113 0.057086 0.556178 Te\n0.499092 0.942914 0.090027 Te\n0.500907 0.590935 0.443821 Te\n",
"nsites": 8,
"nelements": 4,
"elements": [
"Tl",
"In",
"Ga",
"Te"
],
"chemical_system": "Ga-In-Te-Tl",
"density": 6.50401928276077,
"density_atomic": 0.030897533523707877,
"volume": 258.92034371810126,
"volume_molar": 19.49068444372484,
"formula_full": "Tl1 In2 Ga1 Te4",
"formula_reduced": "TlIn2GaTe4",
"formula_anonymous": "ABC2D4",
"energy_above_hull": 0.1887244914583333,
"spacegroup": 23
}
]
}