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=-created_at&page=1114",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-created_at&page=1112",
"results": [
{
"id": "jvasp-98041",
"created_at": "2022-09-04T14:38:12.093401Z",
"updated_at": "2022-09-04T14:38:12.093431Z",
"structure_string": "Ca4 V8 O16\n1.0\n2.971468 -0.000000 0.000000\n0.000000 9.261880 0.000000\n0.000000 0.000000 10.758675\nCa V O\n4 8 16\ndirect\n0.250000 0.242010 0.345057 Ca\n0.250000 0.742010 0.154943 Ca\n0.750000 0.257990 0.845057 Ca\n0.750000 0.757990 0.654943 Ca\n0.250000 0.583470 0.894692 V\n0.750000 0.416530 0.105308 V\n0.750000 0.936446 0.886524 V\n0.750000 0.916530 0.394692 V\n0.250000 0.563554 0.386524 V\n0.750000 0.436446 0.613476 V\n0.250000 0.063554 0.113476 V\n0.250000 0.083470 0.605308 V\n0.750000 0.523811 0.783331 O\n0.250000 0.083231 0.926894 O\n0.750000 0.916769 0.073107 O\n0.250000 0.976189 0.283330 O\n0.750000 0.023811 0.716670 O\n0.250000 0.476189 0.216670 O\n0.250000 0.883050 0.523645 O\n0.250000 0.293259 0.664664 O\n0.250000 0.383050 0.976356 O\n0.750000 0.616950 0.023644 O\n0.250000 0.793259 0.835337 O\n0.750000 0.206741 0.164664 O\n0.750000 0.416769 0.426894 O\n0.750000 0.706741 0.335336 O\n0.750000 0.116950 0.476356 O\n0.250000 0.583231 0.573107 O\n",
"nsites": 28,
"nelements": 3,
"elements": [
"Ca",
"V",
"O"
],
"chemical_system": "Ca-O-V",
"density": 4.620192001122543,
"density_atomic": 0.09456469700716966,
"volume": 296.0935834001256,
"volume_molar": 6.368275847744128,
"formula_full": "Ca4 V8 O16",
"formula_reduced": "CaV2O4",
"formula_anonymous": "AB2C4",
"energy_above_hull": 2.52843326,
"spacegroup": 62
},
{
"id": "jvasp-20580",
"created_at": "2022-09-04T14:38:12.089934Z",
"updated_at": "2022-09-04T14:38:12.089960Z",
"structure_string": "Fe2 S2\n1.0\n1.668841 -2.890518 -0.000000\n1.668841 2.890518 0.000000\n-0.000000 0.000000 5.114456\nFe S\n2 2\ndirect\n0.000000 0.000000 0.000000 Fe\n0.000000 0.000000 0.500000 Fe\n0.333332 0.666667 0.750001 S\n0.666667 0.333332 0.250000 S\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Fe",
"S"
],
"chemical_system": "Fe-S",
"density": 5.916941720900886,
"density_atomic": 0.08106621755043944,
"volume": 49.34237862413154,
"volume_molar": 7.428668737693382,
"formula_full": "Fe2 S2",
"formula_reduced": "FeS",
"formula_anonymous": "AB",
"energy_above_hull": 1.6013577499999996,
"spacegroup": 194
},
{
"id": "jvasp-14775",
"created_at": "2022-09-04T14:38:12.087445Z",
"updated_at": "2022-09-04T14:38:12.087480Z",
"structure_string": "Sc1 Sb1\n1.0\n3.596701 -0.000000 2.076557\n1.198900 3.391002 2.076557\n-0.000000 0.000000 4.153114\nSc Sb\n1 1\ndirect\n0.000000 0.000000 0.000000 Sc\n0.500000 0.500000 0.500001 Sb\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Sc",
"Sb"
],
"chemical_system": "Sb-Sc",
"density": 5.46537437281025,
"density_atomic": 0.039484238061852375,
"volume": 50.65312383303393,
"volume_molar": 15.252012082812053,
"formula_full": "Sc1 Sb1",
"formula_reduced": "ScSb",
"formula_anonymous": "AB",
"energy_above_hull": 0.902910675,
"spacegroup": 225
},
{
"id": "jvasp-52431",
"created_at": "2022-09-04T14:38:12.083041Z",
"updated_at": "2022-09-04T14:38:12.083068Z",
"structure_string": "Fe2 H2 O4\n1.0\n1.415337 5.744120 -0.000000\n-1.415337 5.744120 -0.000000\n0.000000 -0.000000 3.813604\nFe H O\n2 2 4\ndirect\n0.322019 0.322019 0.250000 Fe\n0.677981 0.677981 0.749999 Fe\n0.000000 0.000000 0.500000 H\n0.000000 0.000000 0.000000 H\n0.705803 0.705803 0.250000 O\n0.294197 0.294197 0.749999 O\n0.935029 0.935029 0.250000 O\n0.064971 0.064971 0.749999 O\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Fe",
"H",
"O"
],
"chemical_system": "Fe-H-O",
"density": 4.7587849096926655,
"density_atomic": 0.12901524531826497,
"volume": 62.00817570253012,
"volume_molar": 4.667774529393103,
"formula_full": "Fe2 H2 O4",
"formula_reduced": "FeHO2",
"formula_anonymous": "ABC2",
"energy_above_hull": 2.407645625,
"spacegroup": 63
},
{
"id": "jvasp-64099",
"created_at": "2022-09-04T14:38:12.082764Z",
"updated_at": "2022-09-04T14:38:12.082789Z",
"structure_string": "Ba4 Na1 Re1\n1.0\n0.000000 4.897086 4.897086\n4.897086 -0.000000 4.897086\n4.897086 4.897086 -0.000000\nBa Na Re\n4 1 1\ndirect\n0.119807 0.626732 0.626732 Ba\n0.626732 0.626732 0.626732 Ba\n0.626732 0.119807 0.626732 Ba\n0.626732 0.626732 0.119807 Ba\n0.250000 0.250000 0.250000 Na\n0.000000 0.000000 0.000000 Re\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Ba",
"Na",
"Re"
],
"chemical_system": "Ba-Na-Re",
"density": 5.362461965454075,
"density_atomic": 0.025545126750824352,
"volume": 234.8784587575545,
"volume_molar": 23.57451900216413,
"formula_full": "Ba4 Na1 Re1",
"formula_reduced": "Ba4NaRe",
"formula_anonymous": "ABC4",
"energy_above_hull": 1.1775884799999998,
"spacegroup": 216
},
{
"id": "jvasp-17750",
"created_at": "2022-09-04T14:38:12.079573Z",
"updated_at": "2022-09-04T14:38:12.079609Z",
"structure_string": "Cr4 As2\n1.0\n3.529752 0.000000 0.000000\n0.000000 3.529752 0.000000\n0.000000 0.000000 6.274845\nCr As\n4 2\ndirect\n0.500000 0.000000 0.676003 Cr\n0.000000 0.500000 0.323998 Cr\n0.000000 0.000000 0.000000 Cr\n0.500000 0.500000 0.000000 Cr\n0.500000 0.000000 0.288206 As\n0.000000 0.500000 0.711794 As\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Cr",
"As"
],
"chemical_system": "As-Cr",
"density": 7.60031416681317,
"density_atomic": 0.07674672677332027,
"volume": 78.17922994581446,
"volume_molar": 7.846772120701697,
"formula_full": "Cr4 As2",
"formula_reduced": "Cr2As",
"formula_anonymous": "AB2",
"energy_above_hull": 3.5328921833333338,
"spacegroup": 129
},
{
"id": "jvasp-12556",
"created_at": "2022-09-04T14:38:12.078955Z",
"updated_at": "2022-09-04T14:38:12.078970Z",
"structure_string": "Mg1 Al2 H8\n1.0\n2.621591 -4.540729 -0.000000\n2.621591 4.540729 0.000000\n-0.000000 0.000000 5.822496\nMg Al H\n1 2 8\ndirect\n0.000000 0.000000 0.000000 Mg\n0.333333 0.666667 0.300373 Al\n0.666667 0.333333 0.699628 Al\n0.832345 0.167654 0.806438 H\n0.335310 0.167655 0.806438 H\n0.832345 0.664689 0.806438 H\n0.333333 0.666667 0.576733 H\n0.666667 0.333333 0.423268 H\n0.167654 0.832345 0.193563 H\n0.664689 0.832345 0.193563 H\n0.167655 0.335310 0.193563 H\n",
"nsites": 11,
"nelements": 3,
"elements": [
"Mg",
"Al",
"H"
],
"chemical_system": "Al-H-Mg",
"density": 1.034163387061998,
"density_atomic": 0.07935293054749289,
"volume": 138.6212194572509,
"volume_molar": 7.589059053585597,
"formula_full": "Mg1 Al2 H8",
"formula_reduced": "Mg(AlH4)2",
"formula_anonymous": "AB2C8",
"energy_above_hull": 2.5295195136363637,
"spacegroup": 164
},
{
"id": "jvasp-18008",
"created_at": "2022-09-04T14:38:12.077044Z",
"updated_at": "2022-09-04T14:38:12.077072Z",
"structure_string": "In1 Pd1\n1.0\n3.305350 0.000000 -0.000000\n-0.000000 3.305350 -0.000000\n0.000000 0.000000 3.305350\nIn Pd\n1 1\ndirect\n0.000000 0.000000 0.000000 In\n0.500000 0.500000 0.500000 Pd\n",
"nsites": 2,
"nelements": 2,
"elements": [
"In",
"Pd"
],
"chemical_system": "In-Pd",
"density": 10.173173739451784,
"density_atomic": 0.05538314779204822,
"volume": 36.11206801588037,
"volume_molar": 10.873597836316275,
"formula_full": "In1 Pd1",
"formula_reduced": "InPd",
"formula_anonymous": "AB",
"energy_above_hull": 0.163817835,
"spacegroup": 221
},
{
"id": "jvasp-11815",
"created_at": "2022-09-04T14:38:12.076132Z",
"updated_at": "2022-09-04T14:38:12.076159Z",
"structure_string": "Li6 V2 O8\n1.0\n4.955935 0.000000 0.000000\n0.000000 5.435342 0.000000\n0.000000 0.000000 6.307674\nLi V O\n6 2 8\ndirect\n0.009336 0.667396 0.247741 Li\n0.509336 0.332604 0.252258 Li\n0.509336 0.332604 0.747741 Li\n0.009336 0.667396 0.752258 Li\n0.009746 0.168146 0.500000 Li\n0.509745 0.831854 0.000000 Li\n0.001423 0.169532 0.000000 V\n0.501423 0.830467 0.500000 V\n0.111809 0.320802 0.226835 O\n0.651980 0.172095 0.000000 O\n0.111809 0.320802 0.773164 O\n0.611809 0.679197 0.273165 O\n0.611809 0.679197 0.726835 O\n0.610357 0.134034 0.500000 O\n0.110358 0.865965 0.000000 O\n0.151981 0.827905 0.500000 O\n",
"nsites": 16,
"nelements": 3,
"elements": [
"Li",
"V",
"O"
],
"chemical_system": "Li-O-V",
"density": 2.6536028395022764,
"density_atomic": 0.09416689827951023,
"volume": 169.91108651054972,
"volume_molar": 6.3951779978191725,
"formula_full": "Li6 V2 O8",
"formula_reduced": "Li3VO4",
"formula_anonymous": "AB3C4",
"energy_above_hull": 2.021574775,
"spacegroup": 31
},
{
"id": "jvasp-59191",
"created_at": "2022-09-04T14:38:12.072184Z",
"updated_at": "2022-09-04T14:38:12.072209Z",
"structure_string": "Li2 Fe2 P4 O14\n1.0\n5.233924 -0.127711 -0.931598\n1.260227 5.081545 0.931598\n-0.213377 0.279723 9.272495\nLi Fe P O\n2 2 4 14\ndirect\n0.282196 0.345402 0.518948 Li\n0.654597 0.717805 0.018948 Li\n0.722781 0.637022 0.481376 Fe\n0.362978 0.277220 0.981376 Fe\n0.806904 0.205260 0.292192 P\n0.189481 0.790932 0.704358 P\n0.794739 0.193095 0.792191 P\n0.209068 0.810519 0.204357 P\n0.075429 0.606438 0.612837 O\n0.928295 0.936806 0.748736 O\n0.998568 0.302596 0.885881 O\n0.606235 0.095841 0.885586 O\n0.063192 0.071704 0.248736 O\n0.904158 0.393764 0.385587 O\n0.393561 0.924569 0.112838 O\n0.607826 0.362507 0.143881 O\n0.014638 0.692089 0.116991 O\n0.637495 0.392174 0.643880 O\n0.370472 0.627924 0.859214 O\n0.307910 0.985361 0.616991 O\n0.697401 0.001432 0.385882 O\n0.372073 0.629526 0.359214 O\n",
"nsites": 22,
"nelements": 4,
"elements": [
"Li",
"Fe",
"P",
"O"
],
"chemical_system": "Fe-Li-O-P",
"density": 3.2033369562476026,
"density_atomic": 0.08963841194760272,
"volume": 245.43049706034384,
"volume_molar": 6.718259091337076,
"formula_full": "Li2 Fe2 P4 O14",
"formula_reduced": "LiFeP2O7",
"formula_anonymous": "ABC2D7",
"energy_above_hull": 2.772115545454545,
"spacegroup": 9
},
{
"id": "jvasp-29935",
"created_at": "2022-09-04T14:38:12.068345Z",
"updated_at": "2022-09-04T14:38:12.068371Z",
"structure_string": "Cd9 I18\n1.0\n4.287344 -0.000000 -0.000000\n-2.143672 3.712949 -0.000000\n-0.000000 -0.000000 61.889402\nCd I\n9 18\ndirect\n0.333333 0.666667 0.916665 Cd\n0.333333 0.666667 0.583321 Cd\n0.000000 0.000000 0.138907 Cd\n0.333333 0.666667 0.694440 Cd\n0.333333 0.666667 0.250003 Cd\n0.333333 0.666667 0.027771 Cd\n0.333333 0.666667 0.805572 Cd\n0.333333 0.666667 0.361096 Cd\n0.333333 0.666667 0.472233 Cd\n0.666667 0.333333 0.055796 I\n-0.000000 -0.000000 -0.000231 I\n0.000000 0.000000 0.333088 I\n0.666667 0.333333 0.944677 I\n0.666667 0.333333 0.389110 I\n0.000000 0.000000 0.555314 I\n0.333333 0.666667 0.110908 I\n0.666667 0.333333 0.611333 I\n0.000000 0.000000 0.444223 I\n0.666667 0.333333 0.833584 I\n0.000000 0.000000 0.666432 I\n0.666667 0.333333 0.500245 I\n0.000000 0.000000 0.777562 I\n0.666667 0.333333 0.722454 I\n0.666667 0.333333 0.278014 I\n0.000000 0.000000 0.221998 I\n0.666667 0.333333 0.166928 I\n0.000000 0.000000 0.888656 I\n",
"nsites": 27,
"nelements": 2,
"elements": [
"Cd",
"I"
],
"chemical_system": "Cd-I",
"density": 5.5553316696336195,
"density_atomic": 0.027405653521690384,
"volume": 985.1981810479606,
"volume_molar": 21.97408193617327,
"formula_full": "Cd9 I18",
"formula_reduced": "CdI2",
"formula_anonymous": "AB2",
"energy_above_hull": 0.0001533333333333,
"spacegroup": 156
},
{
"id": "jvasp-97925",
"created_at": "2022-09-04T14:38:12.064087Z",
"updated_at": "2022-09-04T14:38:12.064110Z",
"structure_string": "Mn2 Ag8 Sb4 S12\n1.0\n6.666200 0.000000 -0.273105\n0.000000 7.980418 0.000000\n0.061037 0.000000 10.563819\nMn Ag Sb S\n2 8 4 12\ndirect\n0.000000 0.500000 0.500000 Mn\n0.500000 0.000000 0.000000 Mn\n0.737698 0.466626 0.974230 Ag\n0.427841 0.807156 0.676273 Ag\n0.072160 0.307156 0.823727 Ag\n0.572160 0.192845 0.323727 Ag\n0.927840 0.692845 0.176274 Ag\n0.237698 0.033374 0.474229 Ag\n0.262302 0.533374 0.025771 Ag\n0.762302 0.966626 0.525771 Ag\n0.532074 0.357097 0.691096 Sb\n0.032074 0.142903 0.191095 Sb\n0.467926 0.642903 0.308905 Sb\n0.967926 0.857097 0.808905 Sb\n0.848133 0.241051 0.606671 S\n0.348132 0.258950 0.106671 S\n0.151868 0.758950 0.393330 S\n0.329018 0.329048 0.484939 S\n0.170982 0.829048 0.015062 S\n0.670983 0.670952 0.515062 S\n0.829018 0.170952 0.984939 S\n0.124470 0.596514 0.719034 S\n0.375531 0.096514 0.780966 S\n0.875531 0.403486 0.280966 S\n0.651868 0.741051 0.893330 S\n0.624469 0.903486 0.219034 S\n",
"nsites": 26,
"nelements": 4,
"elements": [
"Mn",
"Ag",
"Sb",
"S"
],
"chemical_system": "Ag-Mn-S-Sb",
"density": 5.449208127150259,
"density_atomic": 0.04625360917506738,
"volume": 562.1182965764125,
"volume_molar": 13.019828868286854,
"formula_full": "Mn2 Ag8 Sb4 S12",
"formula_reduced": "MnAg4(SbS3)2",
"formula_anonymous": "AB2C4D6",
"energy_above_hull": 1.656912960106101,
"spacegroup": 14
}
]
}