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_molar&page=1175",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=volume_molar&page=1173",
"results": [
{
"id": "jvasp-9580",
"created_at": "2022-09-04T14:38:16.632891Z",
"updated_at": "2022-09-04T14:38:16.632901Z",
"structure_string": "Ga3 P3 O12\n1.0\n2.454006 -4.250462 -0.000000\n2.454006 4.250462 0.000000\n0.000000 0.000000 11.155161\nGa P O\n3 3 12\ndirect\n0.546761 0.546761 0.000000 Ga\n0.000001 0.453240 0.666667 Ga\n0.453240 0.000001 0.333333 Ga\n0.547647 0.547647 0.500000 P\n0.000001 0.452354 0.166667 P\n0.452354 0.000001 0.833333 P\n0.082147 0.675187 0.275425 O\n0.917855 0.593042 0.057908 O\n0.675187 0.082147 0.724575 O\n0.406960 0.324814 0.391242 O\n0.405116 0.277167 0.869844 O\n0.127950 0.722835 0.796822 O\n0.872052 0.594886 0.536511 O\n0.593042 0.917855 0.942092 O\n0.594886 0.872052 0.463489 O\n0.277167 0.405116 0.130156 O\n0.722835 0.127950 0.203178 O\n0.324814 0.406960 0.608758 O\n",
"nsites": 18,
"nelements": 3,
"elements": [
"Ga",
"P",
"O"
],
"chemical_system": "Ga-O-P",
"density": 3.525587420107052,
"density_atomic": 0.07734903656109529,
"volume": 232.71136655700204,
"volume_molar": 7.785670032545682,
"formula_full": "Ga3 P3 O12",
"formula_reduced": "GaPO4",
"formula_anonymous": "ABC4",
"energy_above_hull": 1.886671970833334,
"spacegroup": 152
},
{
"id": "jvasp-36576",
"created_at": "2022-09-04T14:37:30.662145Z",
"updated_at": "2022-09-04T14:37:30.662163Z",
"structure_string": "Cr4 N8\n1.0\n-4.898412 -0.023968 -0.031758\n1.710337 4.742414 0.023461\n-0.094474 -1.383794 -6.694430\nCr N\n4 8\ndirect\n0.207515 0.110261 0.909093 Cr\n0.297372 0.007705 0.478925 Cr\n0.509348 0.645886 0.806055 Cr\n0.787280 0.420261 0.191690 Cr\n0.232091 0.266995 0.674431 N\n0.422369 0.798368 0.573305 N\n0.981140 0.748793 0.318485 N\n0.859969 0.826327 0.788107 N\n0.045151 0.239880 0.096457 N\n0.588512 0.427462 0.983748 N\n0.358615 0.851970 0.964838 N\n0.575345 0.215891 0.348799 N\n",
"nsites": 12,
"nelements": 2,
"elements": [
"Cr",
"N"
],
"chemical_system": "Cr-N",
"density": 3.4254977210973907,
"density_atomic": 0.07734892527751053,
"volume": 155.14113424261168,
"volume_molar": 7.7856812339588615,
"formula_full": "Cr4 N8",
"formula_reduced": "CrN2",
"formula_anonymous": "AB2",
"energy_above_hull": 4.509337966666665,
"spacegroup": 1
},
{
"id": "jvasp-90544",
"created_at": "2022-09-04T14:36:06.040242Z",
"updated_at": "2022-09-04T14:36:06.040256Z",
"structure_string": "La2 Cr1 O6\n1.0\n4.712979 -0.129414 2.435839\n1.426300 4.493839 2.435839\n-0.182041 -0.129414 5.302109\nLa Cr O\n2 1 6\ndirect\n0.743126 0.743127 0.743126 La\n0.256874 0.256875 0.256874 La\n0.000000 0.000000 0.000000 Cr\n0.309573 0.788242 0.150586 O\n0.788242 0.150587 0.309573 O\n0.150586 0.309574 0.788242 O\n0.690427 0.211759 0.849414 O\n0.849414 0.690428 0.211758 O\n0.211758 0.849415 0.690427 O\n",
"nsites": 9,
"nelements": 3,
"elements": [
"La",
"Cr",
"O"
],
"chemical_system": "Cr-La-O",
"density": 6.076508280391314,
"density_atomic": 0.07734608575689572,
"volume": 116.36012232458205,
"volume_molar": 7.785967060993905,
"formula_full": "La2 Cr1 O6",
"formula_reduced": "La2CrO6",
"formula_anonymous": "AB2C6",
"energy_above_hull": 2.712263155555556,
"spacegroup": 148
},
{
"id": "jvasp-57819",
"created_at": "2022-09-04T14:37:12.802274Z",
"updated_at": "2022-09-04T14:37:12.802299Z",
"structure_string": "Na4 Cr2 F8\n1.0\n0.000000 3.382178 0.017408\n9.429271 0.000000 0.000000\n0.000000 -0.233188 -5.677028\nNa Cr F\n4 2 8\ndirect\n0.514271 0.818033 0.420169 Na\n0.485729 0.318033 0.079830 Na\n0.514271 0.681967 0.920170 Na\n0.485729 0.181967 0.579831 Na\n0.000000 0.000000 0.000000 Cr\n-0.000000 0.500000 0.500000 Cr\n0.009648 0.695106 0.629308 F\n0.990352 0.195106 0.870692 F\n0.990352 0.304894 0.370692 F\n0.009648 0.804894 0.129308 F\n0.578164 0.951114 0.757093 F\n0.421836 0.451114 0.742907 F\n0.578164 0.548886 0.257093 F\n0.421836 0.048886 0.242907 F\n",
"nsites": 14,
"nelements": 3,
"elements": [
"Na",
"Cr",
"F"
],
"chemical_system": "Cr-F-Na",
"density": 3.191889146375764,
"density_atomic": 0.07734357600734845,
"volume": 181.01050821169497,
"volume_molar": 7.786219710642594,
"formula_full": "Na4 Cr2 F8",
"formula_reduced": "Na2CrF4",
"formula_anonymous": "AB2C4",
"energy_above_hull": 0.1466827333333335,
"spacegroup": 14
},
{
"id": "jvasp-57417",
"created_at": "2022-09-04T14:38:34.238657Z",
"updated_at": "2022-09-04T14:38:34.238684Z",
"structure_string": "Sm4 Mo4 O14\n1.0\n6.392978 -0.000000 3.690987\n2.130993 6.027357 3.690987\n0.000000 0.000000 7.381975\nSm Mo O\n4 4 14\ndirect\n0.500000 -0.000000 0.500000 Sm\n0.500000 0.500000 0.500001 Sm\n0.500000 0.500000 0.000000 Sm\n-0.000000 0.500000 0.500001 Sm\n0.000000 0.000000 0.000000 Mo\n-0.000000 -0.000000 0.500000 Mo\n0.500000 0.000000 0.000000 Mo\n-0.000000 0.500000 0.000000 Mo\n0.333636 0.916364 0.333637 O\n0.625000 0.625000 0.625001 O\n0.083636 0.666364 0.083637 O\n0.333636 0.333636 0.916365 O\n0.333636 0.916364 0.916365 O\n0.083636 0.083636 0.666364 O\n0.916364 0.333636 0.333637 O\n0.375000 0.375000 0.375001 O\n0.666364 0.666364 0.083637 O\n0.916364 0.916364 0.333637 O\n0.083636 0.666364 0.666365 O\n0.666364 0.083636 0.666365 O\n0.916364 0.333636 0.916365 O\n0.666364 0.083636 0.083636 O\n",
"nsites": 22,
"nelements": 3,
"elements": [
"Sm",
"Mo",
"O"
],
"chemical_system": "Mo-O-Sm",
"density": 7.058973045945521,
"density_atomic": 0.0773428168873527,
"volume": 284.44787616207833,
"volume_molar": 7.78629613241402,
"formula_full": "Sm4 Mo4 O14",
"formula_reduced": "Sm2Mo2O7",
"formula_anonymous": "A2B2C7",
"energy_above_hull": 3.253690368181818,
"spacegroup": 227
},
{
"id": "jvasp-41576",
"created_at": "2022-09-04T14:37:38.897962Z",
"updated_at": "2022-09-04T14:37:38.897976Z",
"structure_string": "Mn1 V2 Os1\n1.0\n0.000004 2.957152 2.957153\n2.957152 0.000004 2.957153\n2.957152 2.957152 0.000003\nMn V Os\n1 2 1\ndirect\n0.249999 0.249999 0.249999 Mn\n0.499999 0.499999 0.499999 V\n0.000000 0.000000 0.000000 V\n0.749998 0.749998 0.749998 Os\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Mn",
"V",
"Os"
],
"chemical_system": "Mn-Os-V",
"density": 11.142744555866027,
"density_atomic": 0.07734098733670527,
"volume": 51.71901908345097,
"volume_molar": 7.786480322241699,
"formula_full": "Mn1 V2 Os1",
"formula_reduced": "MnV2Os",
"formula_anonymous": "ABC2",
"energy_above_hull": 4.651042660344828,
"spacegroup": 225
},
{
"id": "jvasp-9773",
"created_at": "2022-09-04T14:37:09.948761Z",
"updated_at": "2022-09-04T14:37:09.948776Z",
"structure_string": "Na4 Ti2 Ge2 O10\n1.0\n6.707612 0.000000 0.000000\n0.000000 6.707612 -0.000000\n0.000000 0.000000 5.172879\nNa Ti Ge O\n4 2 2 10\ndirect\n0.250000 0.750000 0.000000 Na\n0.250000 0.250000 0.000000 Na\n0.750000 0.250000 0.000000 Na\n0.750000 0.750000 0.000000 Na\n0.000000 0.500000 0.573853 Ti\n0.500000 0.000000 0.426147 Ti\n0.000000 0.000000 0.500000 Ge\n0.500000 0.500000 0.500000 Ge\n0.500000 0.283227 0.302850 O\n0.783227 0.000000 0.302850 O\n0.216773 0.000000 0.302850 O\n0.500000 0.716773 0.302850 O\n0.716773 0.500000 0.697150 O\n0.000000 0.216773 0.697150 O\n0.283227 0.500000 0.697150 O\n0.500000 0.000000 0.759819 O\n0.000000 0.783227 0.697150 O\n0.000000 0.500000 0.240181 O\n",
"nsites": 18,
"nelements": 4,
"elements": [
"Na",
"Ti",
"Ge",
"O"
],
"chemical_system": "Ge-Na-O-Ti",
"density": 3.5172142773760533,
"density_atomic": 0.07734002697808408,
"volume": 232.73847583607227,
"volume_molar": 7.786577009737144,
"formula_full": "Na4 Ti2 Ge2 O10",
"formula_reduced": "Na2TiGeO5",
"formula_anonymous": "ABC2D5",
"energy_above_hull": 1.7409177537037035,
"spacegroup": 129
},
{
"id": "jvasp-26879",
"created_at": "2022-09-04T14:37:05.078325Z",
"updated_at": "2022-09-04T14:37:05.078342Z",
"structure_string": "Ba1 Y1 Fe1 Cu1 O5\n1.0\n3.896250 0.000000 0.000000\n0.000000 3.896250 0.000000\n0.000000 0.000000 7.665629\nBa Y Fe Cu O\n1 1 1 1 5\ndirect\n0.000000 0.000000 0.985546 Ba\n0.000000 0.000000 0.459432 Y\n0.500000 0.500000 0.700003 Fe\n0.500000 0.500000 0.254412 Cu\n0.000000 0.500000 0.646523 O\n0.500000 0.000000 0.646523 O\n0.000000 0.500000 0.277063 O\n0.500000 0.000000 0.277063 O\n0.500000 0.500000 0.941352 O\n",
"nsites": 9,
"nelements": 5,
"elements": [
"Ba",
"Y",
"Fe",
"Cu",
"O"
],
"chemical_system": "Ba-Cu-Fe-O-Y",
"density": 6.073381540121195,
"density_atomic": 0.07733945055274287,
"volume": 116.37010523965782,
"volume_molar": 7.786635044547032,
"formula_full": "Ba1 Y1 Fe1 Cu1 O5",
"formula_reduced": "BaYFeCuO5",
"formula_anonymous": "ABCDE5",
"energy_above_hull": 2.072153874444444,
"spacegroup": 99
},
{
"id": "jvasp-11574",
"created_at": "2022-09-04T14:37:17.530259Z",
"updated_at": "2022-09-04T14:37:17.530279Z",
"structure_string": "Mo3 O8\n1.0\n4.451125 -0.433596 -2.195134\n-0.889917 5.289102 -2.849240\n-0.771638 -0.057502 6.606999\nMo O\n3 8\ndirect\n0.499999 0.999998 -0.000001 Mo\n0.999997 0.708932 -0.000001 Mo\n0.999997 0.291066 -0.000000 Mo\n-0.027523 0.370856 0.741712 O\n0.027522 0.629143 0.258288 O\n0.020727 0.890873 0.781746 O\n0.979271 0.109125 0.218252 O\n0.465341 0.334136 0.211483 O\n0.465340 0.877346 0.211483 O\n0.534658 0.122652 0.788517 O\n0.534658 0.665863 0.788516 O\n",
"nsites": 11,
"nelements": 2,
"elements": [
"Mo",
"O"
],
"chemical_system": "Mo-O",
"density": 4.854252898387483,
"density_atomic": 0.07733313662827301,
"volume": 142.24174111642586,
"volume_molar": 7.787270790459964,
"formula_full": "Mo3 O8",
"formula_reduced": "Mo3O8",
"formula_anonymous": "A3B8",
"energy_above_hull": 3.926607790909091,
"spacegroup": 12
},
{
"id": "jvasp-10297",
"created_at": "2022-09-04T14:37:06.702955Z",
"updated_at": "2022-09-04T14:37:06.702974Z",
"structure_string": "K2 Zr1 B2 O6\n1.0\n4.839829 -0.028782 4.409628\n1.930016 4.438447 4.409628\n-0.044187 -0.028782 6.547276\nK Zr B O\n2 1 2 6\ndirect\n0.789768 0.789770 0.789768 K\n0.210232 0.210232 0.210232 K\n0.000000 0.000000 0.000000 Zr\n0.595106 0.595108 0.595107 B\n0.404893 0.404894 0.404893 B\n0.744739 0.295034 0.744740 O\n0.255260 0.255261 0.704967 O\n0.704967 0.255261 0.255261 O\n0.255261 0.704967 0.255260 O\n0.744739 0.744740 0.295033 O\n0.295033 0.744740 0.744739 O\n",
"nsites": 11,
"nelements": 4,
"elements": [
"K",
"Zr",
"B",
"O"
],
"chemical_system": "B-K-O-Zr",
"density": 3.350773420060139,
"density_atomic": 0.07732995208729947,
"volume": 142.24759880339587,
"volume_molar": 7.787591479691433,
"formula_full": "K2 Zr1 B2 O6",
"formula_reduced": "K2Zr(BO3)2",
"formula_anonymous": "AB2C2D6",
"energy_above_hull": 2.5879542424242423,
"spacegroup": 166
},
{
"id": "jvasp-119590",
"created_at": "2022-09-04T14:38:35.880433Z",
"updated_at": "2022-09-04T14:38:35.880465Z",
"structure_string": "Mn4 F12\n1.0\n7.455052 -0.000000 0.000000\n0.000000 5.168489 0.000254\n-0.000000 -0.000106 5.369926\nMn F\n4 12\ndirect\n0.000000 0.000000 0.000000 Mn\n0.500000 -0.000000 -0.000000 Mn\n-0.000000 0.500000 0.500000 Mn\n0.500000 0.500000 0.500000 Mn\n0.250000 0.095183 0.982979 F\n0.547161 0.298362 0.205290 F\n0.952838 0.298362 0.205290 F\n0.047258 0.798364 0.294703 F\n0.452742 0.798364 0.294703 F\n0.750000 0.595283 0.516854 F\n0.250000 0.404716 0.483146 F\n0.547258 0.201635 0.705297 F\n0.952742 0.201635 0.705297 F\n0.047161 0.701638 0.794710 F\n0.452839 0.701638 0.794710 F\n0.750000 0.904816 0.017021 F\n",
"nsites": 16,
"nelements": 2,
"elements": [
"Mn",
"F"
],
"chemical_system": "F-Mn",
"density": 3.593235201444685,
"density_atomic": 0.0773281121921914,
"volume": 206.91052123752323,
"volume_molar": 7.787776772608339,
"formula_full": "Mn4 F12",
"formula_reduced": "MnF3",
"formula_anonymous": "AB3",
"energy_above_hull": 0.3132545222198275,
"spacegroup": 62
},
{
"id": "jvasp-7937",
"created_at": "2022-09-04T14:37:06.373538Z",
"updated_at": "2022-09-04T14:37:06.373568Z",
"structure_string": "Fe2 P4\n1.0\n2.750845 0.000000 0.000000\n0.000000 4.975510 -0.000000\n0.000000 0.000000 5.669109\nFe P\n2 4\ndirect\n0.499999 0.500000 0.500000 Fe\n0.000000 0.000000 0.000000 Fe\n0.499999 0.328730 0.868291 P\n0.499999 0.671270 0.131709 P\n0.000000 0.171270 0.368291 P\n0.000000 0.828730 0.631709 P\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Fe",
"P"
],
"chemical_system": "Fe-P",
"density": 5.041714975766846,
"density_atomic": 0.07732727740775899,
"volume": 77.59228310032239,
"volume_molar": 7.787860845331843,
"formula_full": "Fe2 P4",
"formula_reduced": "FeP2",
"formula_anonymous": "AB2",
"energy_above_hull": 2.5932055,
"spacegroup": 58
}
]
}