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=-nsites&page=1299",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-nsites&page=1297",
"results": [
{
"id": "jvasp-23751",
"created_at": "2022-09-04T14:37:32.830086Z",
"updated_at": "2022-09-04T14:37:32.830110Z",
"structure_string": "Tb4 Sn4 Pt4\n1.0\n4.556574 -0.000000 0.000000\n-0.000000 7.222323 0.000000\n0.000000 0.000000 8.073920\nTb Sn Pt\n4 4 4\ndirect\n0.749999 0.489317 0.806499 Tb\n0.250000 0.010683 0.306499 Tb\n0.749999 0.989317 0.693501 Tb\n0.250000 0.510682 0.193501 Tb\n0.250000 0.675550 0.583861 Sn\n0.250000 0.175550 0.916139 Sn\n0.749999 0.324450 0.416139 Sn\n0.749999 0.824449 0.083861 Sn\n0.250000 0.778261 0.908526 Pt\n0.250000 0.278261 0.591474 Pt\n0.749999 0.721738 0.408526 Pt\n0.749999 0.221739 0.091474 Pt\n",
"nsites": 12,
"nelements": 3,
"elements": [
"Tb",
"Sn",
"Pt"
],
"chemical_system": "Pt-Sn-Tb",
"density": 11.817148461997162,
"density_atomic": 0.04516286340588175,
"volume": 265.70503052818367,
"volume_molar": 13.33427578734016,
"formula_full": "Tb4 Sn4 Pt4",
"formula_reduced": "TbSnPt",
"formula_anonymous": "ABC",
"energy_above_hull": 0.9656738333333336,
"spacegroup": 62
},
{
"id": "jvasp-58425",
"created_at": "2022-09-04T14:37:32.896894Z",
"updated_at": "2022-09-04T14:37:32.896926Z",
"structure_string": "U4 Cr6 Si2\n1.0\n2.567122 -4.446385 0.000000\n2.567122 4.446385 0.000000\n0.000000 -0.000000 8.053991\nU Cr Si\n4 6 2\ndirect\n0.333333 0.666667 0.913955 U\n0.666667 0.333333 0.413955 U\n0.666667 0.333333 0.086045 U\n0.333333 0.666667 0.586045 U\n0.346189 0.173095 0.750000 Cr\n0.826905 0.173095 0.750000 Cr\n0.826905 0.653811 0.750000 Cr\n0.173095 0.826905 0.250000 Cr\n0.173095 0.346189 0.250000 Cr\n0.653811 0.826905 0.250000 Cr\n0.000000 0.000000 0.000000 Si\n0.000000 0.000000 0.500000 Si\n",
"nsites": 12,
"nelements": 3,
"elements": [
"U",
"Cr",
"Si"
],
"chemical_system": "Cr-Si-U",
"density": 11.923806518230867,
"density_atomic": 0.06526593100261432,
"volume": 183.86315518151918,
"volume_molar": 9.227081675673599,
"formula_full": "U4 Cr6 Si2",
"formula_reduced": "U2Cr3Si",
"formula_anonymous": "AB2C3",
"energy_above_hull": 5.4303738,
"spacegroup": 194
},
{
"id": "jvasp-23832",
"created_at": "2022-09-04T14:37:40.069038Z",
"updated_at": "2022-09-04T14:37:40.069073Z",
"structure_string": "Hf4 Nb4 P4\n1.0\n3.541887 -0.000000 0.000000\n-0.000000 6.894835 0.000000\n0.000000 0.000000 8.351709\nHf Nb P\n4 4 4\ndirect\n0.250000 0.533617 0.832896 Hf\n0.250000 0.033617 0.667104 Hf\n0.750001 0.966384 0.332896 Hf\n0.750001 0.466384 0.167104 Hf\n0.750001 0.358393 0.559801 Nb\n0.250000 0.141607 0.059801 Nb\n0.750001 0.858394 0.940199 Nb\n0.250000 0.641607 0.440199 Nb\n0.250000 0.761724 0.145105 P\n0.250000 0.261723 0.354895 P\n0.750001 0.238277 0.854895 P\n0.750001 0.738278 0.645105 P\n",
"nsites": 12,
"nelements": 3,
"elements": [
"Hf",
"Nb",
"P"
],
"chemical_system": "Hf-Nb-P",
"density": 9.847229506253564,
"density_atomic": 0.05883656548652633,
"volume": 203.954800909445,
"volume_molar": 10.235370997953783,
"formula_full": "Hf4 Nb4 P4",
"formula_reduced": "HfNbP",
"formula_anonymous": "ABC",
"energy_above_hull": 3.7927293,
"spacegroup": 62
},
{
"id": "jvasp-23336",
"created_at": "2022-09-04T14:37:44.723742Z",
"updated_at": "2022-09-04T14:37:44.723765Z",
"structure_string": "Er4 Ge4 Ru4\n1.0\n4.398904 -0.000000 0.000000\n0.000000 6.953371 0.000000\n0.000000 0.000000 7.230575\nEr Ge Ru\n4 4 4\ndirect\n0.250000 0.487287 0.192344 Er\n0.749999 0.512713 0.807656 Er\n0.250000 0.987287 0.307656 Er\n0.749999 0.012713 0.692345 Er\n0.250000 0.794763 0.893227 Ge\n0.749999 0.205236 0.106773 Ge\n0.250000 0.294764 0.606774 Ge\n0.749999 0.705236 0.393227 Ge\n0.749999 0.842780 0.062772 Ru\n0.250000 0.157220 0.937229 Ru\n0.749999 0.342780 0.437228 Ru\n0.250000 0.657220 0.562772 Ru\n",
"nsites": 12,
"nelements": 3,
"elements": [
"Er",
"Ge",
"Ru"
],
"chemical_system": "Er-Ge-Ru",
"density": 10.240266596218989,
"density_atomic": 0.054258592614285825,
"volume": 221.1631268305419,
"volume_molar": 11.098962339127135,
"formula_full": "Er4 Ge4 Ru4",
"formula_reduced": "ErGeRu",
"formula_anonymous": "ABC",
"energy_above_hull": 1.731435483333333,
"spacegroup": 62
},
{
"id": "jvasp-28943",
"created_at": "2022-09-04T14:37:55.210324Z",
"updated_at": "2022-09-04T14:37:55.210355Z",
"structure_string": "Mo1 W3 Se4 S4\n1.0\n3.256999 -0.000015 0.000018\n-1.628512 2.820644 -0.000009\n0.000187 0.000020 34.422381\nMo W Se S\n1 3 4 4\ndirect\n0.333320 0.666624 0.091724 Mo\n0.333338 0.666670 0.472610 W\n0.666659 0.333322 0.285486 W\n0.666683 0.333380 0.653092 W\n0.333308 0.666643 0.335126 Se\n0.666642 0.333272 0.042432 Se\n0.666662 0.333305 0.141079 Se\n0.333347 0.666670 0.235833 Se\n0.333347 0.666726 0.698193 S\n0.666687 0.333352 0.427471 S\n0.666655 0.333316 0.517738 S\n0.333352 0.666704 0.607963 S\n",
"nsites": 12,
"nelements": 4,
"elements": [
"Mo",
"W",
"Se",
"S"
],
"chemical_system": "Mo-S-Se-W",
"density": 5.7318003699670035,
"density_atomic": 0.03794683789961884,
"volume": 316.231882923782,
"volume_molar": 15.869940931390463,
"formula_full": "Mo1 W3 Se4 S4",
"formula_reduced": "MoW3(SeS)4",
"formula_anonymous": "AB3C4D4",
"energy_above_hull": 4.303070780555556,
"spacegroup": 156
},
{
"id": "jvasp-54866",
"created_at": "2022-09-04T14:37:55.247887Z",
"updated_at": "2022-09-04T14:37:55.247919Z",
"structure_string": "Mn4 Br8\n1.0\n6.659206 0.000000 3.844694\n2.219735 6.278360 3.844694\n0.000000 0.000000 7.689389\nMn Br\n4 8\ndirect\n0.500001 0.500000 -0.000001 Mn\n0.500001 0.500000 0.499999 Mn\n0.500000 -0.000000 0.500000 Mn\n0.000000 0.500000 0.500000 Mn\n0.747326 0.747325 0.747324 Br\n0.747326 0.258026 0.747324 Br\n0.252675 0.252675 0.252675 Br\n0.252676 0.741974 0.252674 Br\n0.252675 0.252675 0.741974 Br\n0.258027 0.747325 0.747324 Br\n0.741975 0.252675 0.252674 Br\n0.747326 0.747325 0.258025 Br\n",
"nsites": 12,
"nelements": 2,
"elements": [
"Mn",
"Br"
],
"chemical_system": "Br-Mn",
"density": 4.436839989547396,
"density_atomic": 0.037326799135069,
"volume": 321.48483872344275,
"volume_molar": 16.133557924987258,
"formula_full": "Mn4 Br8",
"formula_reduced": "MnBr2",
"formula_anonymous": "AB2",
"energy_above_hull": 0.9511184837931036,
"spacegroup": 227
},
{
"id": "jvasp-23867",
"created_at": "2022-09-04T14:37:40.068270Z",
"updated_at": "2022-09-04T14:37:40.068305Z",
"structure_string": "Na2 Cl2 O8\n1.0\n4.757048 -0.017549 -0.000000\n-0.407573 4.739588 0.000000\n-0.000000 0.000000 7.030431\nNa Cl O\n2 2 8\ndirect\n0.656248 0.656247 0.250000 Na\n0.343753 0.343753 0.750000 Na\n0.158417 0.158417 0.250000 Cl\n0.841584 0.841583 0.750000 Cl\n0.142695 0.806725 0.750000 O\n0.857306 0.193275 0.250000 O\n0.806725 0.142694 0.750000 O\n0.193276 0.857306 0.250000 O\n0.291947 0.291947 0.083098 O\n0.708054 0.708053 0.583098 O\n0.291947 0.291947 0.416902 O\n0.708054 0.708053 0.916902 O\n",
"nsites": 12,
"nelements": 3,
"elements": [
"Na",
"Cl",
"O"
],
"chemical_system": "Cl-Na-O",
"density": 2.566146483728615,
"density_atomic": 0.07572843220911872,
"volume": 158.46095911325415,
"volume_molar": 7.952285006205177,
"formula_full": "Na2 Cl2 O8",
"formula_reduced": "NaClO4",
"formula_anonymous": "ABC4",
"energy_above_hull": 1.6446003686111117,
"spacegroup": 63
},
{
"id": "jvasp-35223",
"created_at": "2022-09-04T14:37:37.027881Z",
"updated_at": "2022-09-04T14:37:37.027895Z",
"structure_string": "Cu8 Se4\n1.0\n4.307579 0.000000 0.000000\n0.000000 4.307579 -0.000000\n-0.000000 -0.000000 10.960803\nCu Se\n8 4\ndirect\n0.108361 0.568066 0.331529 Cu\n0.391639 0.068066 0.418471 Cu\n0.931934 0.608361 0.081529 Cu\n0.891639 0.431934 0.831529 Cu\n0.431934 0.891639 0.168471 Cu\n0.608361 0.931934 0.918470 Cu\n0.068066 0.391639 0.581529 Cu\n0.568066 0.108361 0.668470 Cu\n0.399906 0.600095 0.750000 Se\n0.100094 0.100094 0.000000 Se\n0.899906 0.899906 0.500000 Se\n0.600095 0.399906 0.250000 Se\n",
"nsites": 12,
"nelements": 2,
"elements": [
"Cu",
"Se"
],
"chemical_system": "Cu-Se",
"density": 6.7294109231665376,
"density_atomic": 0.05900276603749806,
"volume": 203.38029563518486,
"volume_molar": 10.206539734379142,
"formula_full": "Cu8 Se4",
"formula_reduced": "Cu2Se",
"formula_anonymous": "AB2",
"energy_above_hull": 0.1429047555555556,
"spacegroup": 96
},
{
"id": "jvasp-58233",
"created_at": "2022-09-04T14:37:35.492366Z",
"updated_at": "2022-09-04T14:37:35.492398Z",
"structure_string": "Nb8 Co2 Si2\n1.0\n6.223362 0.000000 0.000000\n0.000000 6.223362 -0.000000\n0.000000 0.000000 5.032749\nNb Co Si\n8 2 2\ndirect\n0.333121 0.151287 0.500000 Nb\n0.666878 0.848713 0.500000 Nb\n0.151287 0.666878 0.500000 Nb\n0.848713 0.333121 0.500000 Nb\n0.333121 0.848713 0.000000 Nb\n0.848713 0.666878 0.000000 Nb\n0.151287 0.333121 0.000000 Nb\n0.666878 0.151287 0.000000 Nb\n0.000000 0.000000 0.750000 Co\n0.000000 0.000000 0.250000 Co\n0.500000 0.500000 0.750000 Si\n0.500000 0.500000 0.250000 Si\n",
"nsites": 12,
"nelements": 3,
"elements": [
"Nb",
"Co",
"Si"
],
"chemical_system": "Co-Nb-Si",
"density": 7.8144715514539556,
"density_atomic": 0.061563860777096045,
"volume": 194.9195493675801,
"volume_molar": 9.781941359727801,
"formula_full": "Nb8 Co2 Si2",
"formula_reduced": "Nb4CoSi",
"formula_anonymous": "ABC4",
"energy_above_hull": 5.196412850000001,
"spacegroup": 124
},
{
"id": "jvasp-11114",
"created_at": "2022-09-04T14:37:32.927698Z",
"updated_at": "2022-09-04T14:37:32.927732Z",
"structure_string": "Sr2 Lu2 Cu2 S6\n1.0\n3.892563 0.000000 0.000000\n-1.946282 6.469782 0.000000\n0.000000 -0.000000 9.970818\nSr Lu Cu S\n2 2 2 6\ndirect\n0.251649 0.503300 0.750000 Sr\n0.748350 0.496700 0.250000 Sr\n0.000000 0.000000 0.000000 Lu\n0.000000 0.000000 0.500000 Lu\n0.470712 0.941423 0.250000 Cu\n0.529288 0.058577 0.750000 Cu\n0.924413 0.848826 0.750000 S\n0.075587 0.151173 0.250000 S\n0.363670 0.727339 0.062151 S\n0.363670 0.727339 0.437849 S\n0.636329 0.272660 0.562151 S\n0.636329 0.272660 0.937849 S\n",
"nsites": 12,
"nelements": 4,
"elements": [
"Sr",
"Lu",
"Cu",
"S"
],
"chemical_system": "Cu-Lu-S-Sr",
"density": 5.585639237810704,
"density_atomic": 0.04778869372094615,
"volume": 251.1054198315596,
"volume_molar": 12.601601531871228,
"formula_full": "Sr2 Lu2 Cu2 S6",
"formula_reduced": "SrLuCuS3",
"formula_anonymous": "ABCD3",
"energy_above_hull": 0.8093537516666667,
"spacegroup": 63
},
{
"id": "jvasp-28604",
"created_at": "2022-09-04T14:37:46.763933Z",
"updated_at": "2022-09-04T14:37:46.763949Z",
"structure_string": "Te2 Mo2 W2 Se2 S4\n1.0\n3.314476 -0.000006 -0.000000\n-1.657243 2.870358 0.000006\n-0.000003 0.000062 37.499004\nTe Mo W Se S\n2 2 2 2 4\ndirect\n0.333355 0.666707 0.333231 Te\n0.333359 0.666716 0.230368 Te\n0.333300 0.666597 0.093917 Mo\n0.333317 0.666634 0.469722 Mo\n0.666696 0.333389 0.281804 W\n0.666690 0.333380 0.657492 W\n0.333353 0.666702 0.702412 Se\n0.333363 0.666724 0.612501 Se\n0.666651 0.333297 0.053262 S\n0.666643 0.333281 0.428943 S\n0.666648 0.333292 0.134643 S\n0.666640 0.333274 0.510454 S\n",
"nsites": 12,
"nelements": 5,
"elements": [
"Te",
"Mo",
"W",
"Se",
"S"
],
"chemical_system": "Mo-S-Se-Te-W",
"density": 5.124394122376614,
"density_atomic": 0.03363651722201007,
"volume": 356.75512779152405,
"volume_molar": 17.903579970102882,
"formula_full": "Te2 Mo2 W2 Se2 S4",
"formula_reduced": "TeMoWSeS2",
"formula_anonymous": "ABCDE2",
"energy_above_hull": 3.616847838888889,
"spacegroup": 156
},
{
"id": "jvasp-23505",
"created_at": "2022-09-04T14:37:40.052760Z",
"updated_at": "2022-09-04T14:37:40.052783Z",
"structure_string": "Os4 S8\n1.0\n5.689579 0.000000 0.000000\n0.000000 5.689579 0.000000\n0.000000 -0.000000 5.689579\nOs S\n4 8\ndirect\n0.000000 0.500000 0.500000 Os\n0.500000 0.500000 0.000000 Os\n0.500000 0.000000 0.500000 Os\n0.000000 0.000000 0.000000 Os\n0.383387 0.116613 0.883387 S\n0.116613 0.883387 0.383387 S\n0.883387 0.383387 0.116613 S\n0.616613 0.616613 0.616613 S\n0.383387 0.383387 0.383387 S\n0.116613 0.616613 0.883387 S\n0.883387 0.116613 0.616613 S\n0.616613 0.883387 0.116613 S\n",
"nsites": 12,
"nelements": 2,
"elements": [
"Os",
"S"
],
"chemical_system": "Os-S",
"density": 9.173129172548355,
"density_atomic": 0.06515396497779401,
"volume": 184.17912101112927,
"volume_molar": 9.242938264850784,
"formula_full": "Os4 S8",
"formula_reduced": "OsS2",
"formula_anonymous": "AB2",
"energy_above_hull": 2.7361850000000008,
"spacegroup": 205
}
]
}