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=1201",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-volume&page=1199",
"results": [
{
"id": "jvasp-66315",
"created_at": "2022-09-04T14:36:14.792135Z",
"updated_at": "2022-09-04T14:36:14.792162Z",
"structure_string": "Ba4 Ge1 P1\n1.0\n0.000000 4.812683 4.812683\n4.812683 0.000000 4.812683\n4.812683 4.812683 -0.000000\nBa Ge P\n4 1 1\ndirect\n0.123388 0.625537 0.625537 Ba\n0.625537 0.625537 0.625537 Ba\n0.625537 0.123388 0.625537 Ba\n0.625537 0.625537 0.123388 Ba\n0.250000 0.250000 0.250000 Ge\n0.000000 0.000000 0.000000 P\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Ba",
"Ge",
"P"
],
"chemical_system": "Ba-Ge-P",
"density": 4.863159075803989,
"density_atomic": 0.02691283722555779,
"volume": 222.94193472481962,
"volume_molar": 22.376461870326594,
"formula_full": "Ba4 Ge1 P1",
"formula_reduced": "Ba4GeP",
"formula_anonymous": "ABC4",
"energy_above_hull": 0.5772208883333333,
"spacegroup": 216
},
{
"id": "jvasp-116473",
"created_at": "2022-09-04T14:38:43.256823Z",
"updated_at": "2022-09-04T14:38:43.256852Z",
"structure_string": "Sm4 Ga4 Ni4\n1.0\n4.335996 -0.000000 0.000000\n0.000000 6.968804 0.000000\n0.000000 -0.000000 7.378017\nSm Ga Ni\n4 4 4\ndirect\n0.250000 0.023726 0.805967 Sm\n0.250000 0.523725 0.694033 Sm\n0.750001 0.976274 0.194033 Sm\n0.750001 0.476274 0.305967 Sm\n0.250000 0.172488 0.421008 Ga\n0.250000 0.672488 0.078992 Ga\n0.750001 0.827512 0.578992 Ga\n0.750001 0.327512 0.921008 Ga\n0.250000 0.792896 0.405320 Ni\n0.250000 0.292896 0.094680 Ni\n0.750001 0.207103 0.594680 Ni\n0.750001 0.707103 0.905321 Ni\n",
"nsites": 12,
"nelements": 3,
"elements": [
"Sm",
"Ga",
"Ni"
],
"chemical_system": "Ga-Ni-Sm",
"density": 8.305739767402205,
"density_atomic": 0.053826293056920535,
"volume": 222.93937253509492,
"volume_molar": 11.18810235293683,
"formula_full": "Sm4 Ga4 Ni4",
"formula_reduced": "SmGaNi",
"formula_anonymous": "ABC",
"energy_above_hull": 0.4142545333333333,
"spacegroup": 62
},
{
"id": "jvasp-112408",
"created_at": "2022-09-04T14:38:39.793927Z",
"updated_at": "2022-09-04T14:38:39.793944Z",
"structure_string": "Zn2 Ni2 Ge4 O12\n1.0\n5.143436 -0.049124 0.825008\n0.983063 6.528249 0.501783\n-0.060574 0.018072 6.620609\nZn Ni Ge O\n2 2 4 12\ndirect\n0.750001 0.267793 0.732208 Zn\n0.249999 0.732208 0.267791 Zn\n0.250001 0.090344 0.909655 Ni\n0.750000 0.909656 0.090344 Ni\n0.787065 0.395318 0.205277 Ge\n0.712936 0.794724 0.604681 Ge\n0.212935 0.604683 0.794722 Ge\n0.287063 0.205277 0.395318 Ge\n0.628544 0.973533 0.798430 O\n0.871455 0.201573 0.026469 O\n0.617047 0.630850 0.132897 O\n0.882957 0.867104 0.369148 O\n0.382954 0.369150 0.867103 O\n0.908645 0.569078 0.706850 O\n0.091355 0.430922 0.293149 O\n0.408643 0.706851 0.569077 O\n0.128545 0.798428 0.973531 O\n0.591359 0.293150 0.430922 O\n0.117044 0.132896 0.630853 O\n0.371457 0.026467 0.201569 O\n",
"nsites": 20,
"nelements": 4,
"elements": [
"Zn",
"Ni",
"Ge",
"O"
],
"chemical_system": "Ge-Ni-O-Zn",
"density": 5.443443471914177,
"density_atomic": 0.08971834933580919,
"volume": 222.91983911943663,
"volume_molar": 6.712273246869009,
"formula_full": "Zn2 Ni2 Ge4 O12",
"formula_reduced": "ZnNi(GeO3)2",
"formula_anonymous": "ABC2D6",
"energy_above_hull": 1.7075375699999995,
"spacegroup": 15
},
{
"id": "jvasp-21191",
"created_at": "2022-09-04T14:37:04.106652Z",
"updated_at": "2022-09-04T14:37:04.106668Z",
"structure_string": "Ca4 Ni2 Ir2 O12\n1.0\n0.000000 5.309356 -0.000714\n5.551116 0.000000 0.000000\n0.000000 -5.287080 -7.562026\nCa Ni Ir O\n4 2 2 12\ndirect\n0.231723 0.936248 0.249009 Ca\n0.768277 0.436247 0.250991 Ca\n0.231724 0.563753 0.749009 Ca\n0.768277 0.063753 0.750991 Ca\n0.000000 0.500000 0.000000 Ni\n0.000000 0.000000 0.500000 Ni\n0.500000 0.500000 0.500000 Ir\n0.500000 0.000000 -0.000000 Ir\n0.145206 0.799158 0.950023 O\n0.255261 0.300527 0.949863 O\n0.854795 0.299157 0.549977 O\n0.653615 0.029393 0.252602 O\n0.346386 0.970608 0.747398 O\n0.854795 0.200843 0.049977 O\n0.744740 0.699474 0.050137 O\n0.255261 0.199474 0.449863 O\n0.744740 0.800527 0.550137 O\n0.653615 0.470608 0.752603 O\n0.145205 0.700844 0.450022 O\n0.346385 0.529393 0.247397 O\n",
"nsites": 20,
"nelements": 4,
"elements": [
"Ca",
"Ni",
"Ir",
"O"
],
"chemical_system": "Ca-Ir-Ni-O",
"density": 6.36311378219761,
"density_atomic": 0.08972817787344721,
"volume": 222.89542119319572,
"volume_molar": 6.711538005924558,
"formula_full": "Ca4 Ni2 Ir2 O12",
"formula_reduced": "Ca2NiIrO6",
"formula_anonymous": "ABC2D6",
"energy_above_hull": 2.116672534,
"spacegroup": 14
},
{
"id": "jvasp-42998",
"created_at": "2022-09-04T14:38:10.680100Z",
"updated_at": "2022-09-04T14:38:10.680128Z",
"structure_string": "Mn6 O2 F10\n1.0\n0.000000 4.768295 -0.000825\n9.760868 0.000000 0.000000\n0.000000 -0.000636 -4.789031\nMn O F\n6 2 10\ndirect\n0.968820 0.000000 0.023462 Mn\n0.996594 0.657444 0.984206 Mn\n0.996594 0.342557 0.984206 Mn\n0.503399 0.157446 0.484211 Mn\n0.503399 0.842554 0.484211 Mn\n0.531173 0.500000 0.523451 Mn\n0.820946 0.500000 0.805679 O\n0.679045 0.000000 0.305679 O\n0.185919 0.823749 0.190347 F\n0.314082 0.323751 0.690347 F\n0.314082 0.676249 0.690347 F\n0.272073 0.000000 0.712439 F\n0.792084 0.832414 0.804657 F\n0.707911 0.667586 0.304656 F\n0.792084 0.167586 0.804657 F\n0.227919 0.500000 0.212438 F\n0.707911 0.332415 0.304656 F\n0.185919 0.176252 0.190347 F\n",
"nsites": 18,
"nelements": 3,
"elements": [
"Mn",
"O",
"F"
],
"chemical_system": "F-Mn-O",
"density": 4.109442251844891,
"density_atomic": 0.08075571954252728,
"volume": 222.89442905057527,
"volume_molar": 7.457231257568875,
"formula_full": "Mn6 O2 F10",
"formula_reduced": "Mn3OF5",
"formula_anonymous": "AB3C5",
"energy_above_hull": 1.6355407374042146,
"spacegroup": 31
},
{
"id": "jvasp-21259",
"created_at": "2022-09-04T14:38:05.666924Z",
"updated_at": "2022-09-04T14:38:05.666943Z",
"structure_string": "Li12 B4 N8\n1.0\n0.000000 5.115285 0.005787\n7.050604 0.000000 0.000000\n0.000000 -2.615302 -6.183158\nLi B N\n12 4 8\ndirect\n0.249893 0.515503 0.499084 Li\n0.257656 0.207733 0.686586 Li\n0.257656 0.292267 0.186585 Li\n0.742345 0.792267 0.313414 Li\n0.251901 0.512027 0.875160 Li\n0.748101 0.012027 0.624840 Li\n0.742345 0.707732 0.813415 Li\n0.251901 0.987973 0.375160 Li\n0.249894 0.984496 0.999084 Li\n0.750108 0.484496 0.500916 Li\n0.750108 0.015503 0.000915 Li\n0.748100 0.487973 0.124840 Li\n0.785256 0.319615 0.823855 B\n0.214746 0.819615 0.676145 B\n0.214746 0.680385 0.176145 B\n0.785255 0.180385 0.323855 B\n0.006656 0.203033 0.865388 N\n0.434836 0.561498 0.218193 N\n0.565165 0.061498 0.281806 N\n0.565165 0.438502 0.781807 N\n0.434836 0.938502 0.718193 N\n0.993345 0.796966 0.134612 N\n0.006656 0.296966 0.365387 N\n0.993346 0.703033 0.634612 N\n",
"nsites": 24,
"nelements": 3,
"elements": [
"Li",
"B",
"N"
],
"chemical_system": "B-Li-N",
"density": 1.777468731631976,
"density_atomic": 0.107674435788506,
"volume": 222.89413289465267,
"volume_molar": 5.5929160119572705,
"formula_full": "Li12 B4 N8",
"formula_reduced": "Li3BN2",
"formula_anonymous": "AB2C3",
"energy_above_hull": 2.9514531805555557,
"spacegroup": 14
},
{
"id": "jvasp-122096",
"created_at": "2022-09-04T14:38:55.224234Z",
"updated_at": "2022-09-04T14:38:55.224253Z",
"structure_string": "Sr2 Zr2 F12\n1.0\n6.678420 -0.002693 0.000000\n-2.351456 6.250756 0.000000\n-0.000000 -0.000000 5.340139\nSr Zr F\n2 2 12\ndirect\n0.250000 0.750001 0.452471 Sr\n0.750000 0.250001 0.547529 Sr\n0.750000 0.750001 -0.000000 Zr\n0.250000 0.250000 -0.000000 Zr\n0.683014 0.939931 0.262122 F\n0.316986 0.060070 0.737878 F\n0.816986 0.560071 0.262122 F\n0.560070 0.816986 0.737878 F\n0.183014 0.439930 0.737878 F\n0.439930 0.183015 0.262122 F\n0.939930 0.683015 0.737878 F\n0.060070 0.316986 0.262122 F\n0.423500 0.576500 0.155421 F\n0.576500 0.423501 0.844579 F\n0.076499 0.923501 0.155421 F\n0.923500 0.076500 0.844579 F\n",
"nsites": 16,
"nelements": 3,
"elements": [
"Sr",
"Zr",
"F"
],
"chemical_system": "F-Sr-Zr",
"density": 4.363231574188484,
"density_atomic": 0.07178389695884453,
"volume": 222.8912148524507,
"volume_molar": 8.38926418755538,
"formula_full": "Sr2 Zr2 F12",
"formula_reduced": "SrZrF6",
"formula_anonymous": "ABC6",
"energy_above_hull": null,
"spacegroup": 67
},
{
"id": "jvasp-50141",
"created_at": "2022-09-04T14:36:50.972118Z",
"updated_at": "2022-09-04T14:36:50.972127Z",
"structure_string": "Ho4 Ga4 O12\n1.0\n5.263895 -0.000000 0.000000\n-0.000000 5.585319 0.000000\n0.000000 0.000000 7.581163\nHo Ga O\n4 4 12\ndirect\n0.019824 0.070664 0.990926 Ho\n0.480176 0.570664 0.990926 Ho\n0.519823 0.429336 0.490926 Ho\n0.980175 0.929336 0.490926 Ho\n-0.000000 0.500000 0.240926 Ga\n0.500000 0.000000 0.240926 Ga\n0.499999 -0.000000 0.740926 Ga\n0.000000 0.500000 0.740926 Ga\n0.807904 0.194657 0.298088 O\n0.692094 0.694657 0.298088 O\n0.692093 0.694656 0.683764 O\n0.612750 0.961377 0.990926 O\n0.387249 0.038623 0.490926 O\n0.192094 0.805344 0.183764 O\n0.307905 0.305343 0.798088 O\n0.192095 0.805343 0.798088 O\n0.807906 0.194656 0.683764 O\n0.112750 0.538623 0.490926 O\n0.307906 0.305344 0.183764 O\n0.887249 0.461377 0.990926 O\n",
"nsites": 20,
"nelements": 3,
"elements": [
"Ho",
"Ga",
"O"
],
"chemical_system": "Ga-Ho-O",
"density": 8.4230500158269,
"density_atomic": 0.08973026722332719,
"volume": 222.8902311214849,
"volume_molar": 6.711381729212575,
"formula_full": "Ho4 Ga4 O12",
"formula_reduced": "HoGaO3",
"formula_anonymous": "ABC3",
"energy_above_hull": 1.1533516783333333,
"spacegroup": 62
},
{
"id": "jvasp-86931",
"created_at": "2022-09-04T14:35:44.316697Z",
"updated_at": "2022-09-04T14:35:44.316713Z",
"structure_string": "La3 Cu4 P4 O2\n1.0\n4.023080 0.000000 -0.599438\n-0.089316 4.022089 -0.599438\n-0.003629 -0.003711 13.775647\nLa Cu P O\n3 4 4 2\ndirect\n0.295802 0.295803 0.591605 La\n0.704197 0.704198 0.408395 La\n0.000000 0.000000 0.000000 La\n0.405219 0.905220 0.810439 Cu\n0.094780 0.594781 0.189561 Cu\n0.594780 0.094780 0.189561 Cu\n0.905219 0.405220 0.810439 Cu\n0.457828 0.457829 0.915658 P\n0.139274 0.139274 0.278547 P\n0.860725 0.860726 0.721453 P\n0.542171 0.542172 0.084342 P\n0.750000 0.250000 0.500000 O\n0.249999 0.750000 0.500000 O\n",
"nsites": 13,
"nelements": 4,
"elements": [
"La",
"Cu",
"P",
"O"
],
"chemical_system": "Cu-La-O-P",
"density": 6.159693043780351,
"density_atomic": 0.05832515122415661,
"volume": 222.88840623898412,
"volume_molar": 10.325118124178653,
"formula_full": "La3 Cu4 P4 O2",
"formula_reduced": "La3Cu4(P2O)2",
"formula_anonymous": "A2B3C4D4",
"energy_above_hull": 1.8393673692307688,
"spacegroup": 139
},
{
"id": "jvasp-37451",
"created_at": "2022-09-04T14:37:58.762623Z",
"updated_at": "2022-09-04T14:37:58.762657Z",
"structure_string": "Sm6 Ag2\n1.0\n3.470833 -6.011658 -0.000000\n3.470833 6.011658 0.000000\n0.000000 0.000000 5.340523\nSm Ag\n6 2\ndirect\n0.825554 0.651109 0.750000 Sm\n0.825554 0.174445 0.750000 Sm\n0.348891 0.174445 0.750000 Sm\n0.174445 0.348891 0.250000 Sm\n0.174445 0.825554 0.250000 Sm\n0.651109 0.825554 0.250000 Sm\n0.666667 0.333333 0.250000 Ag\n0.333333 0.666667 0.750000 Ag\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Sm",
"Ag"
],
"chemical_system": "Ag-Sm",
"density": 8.329307311780626,
"density_atomic": 0.03589617863134684,
"volume": 222.86494844367328,
"volume_molar": 16.776551124974294,
"formula_full": "Sm6 Ag2",
"formula_reduced": "Sm3Ag",
"formula_anonymous": "AB3",
"energy_above_hull": 1.0761659712499998,
"spacegroup": 194
},
{
"id": "jvasp-66666",
"created_at": "2022-09-04T14:36:21.124655Z",
"updated_at": "2022-09-04T14:36:21.124678Z",
"structure_string": "Ba4 P1 W1\n1.0\n-0.000000 4.812098 4.812098\n4.812098 -0.000000 4.812098\n4.812098 4.812098 0.000000\nBa P W\n4 1 1\ndirect\n0.126263 0.624579 0.624579 Ba\n0.624579 0.624579 0.624579 Ba\n0.624579 0.126263 0.624579 Ba\n0.624579 0.624579 0.126263 Ba\n0.250000 0.250000 0.250000 P\n0.000000 0.000000 0.000000 W\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Ba",
"P",
"W"
],
"chemical_system": "Ba-P-W",
"density": 5.693486304761618,
"density_atomic": 0.026922653686381123,
"volume": 222.86064627556055,
"volume_molar": 22.368303028933255,
"formula_full": "Ba4 P1 W1",
"formula_reduced": "Ba4PW",
"formula_anonymous": "ABC4",
"energy_above_hull": 2.0279215633333334,
"spacegroup": 216
},
{
"id": "jvasp-59872",
"created_at": "2022-09-04T14:38:35.571837Z",
"updated_at": "2022-09-04T14:38:35.571847Z",
"structure_string": "Al2 Co4 S8\n1.0\n6.025012 -0.000000 -3.163208\n-1.660725 5.791612 -3.163208\n-0.278387 -0.369433 6.789323\nAl Co S\n2 4 8\ndirect\n0.375001 0.625001 0.749999 Al\n0.624999 0.375000 0.250000 Al\n0.000000 0.500001 0.000001 Co\n0.000001 0.000000 0.500000 Co\n0.500001 0.000000 0.500000 Co\n0.000000 0.000000 0.000000 Co\n0.762776 0.788316 0.525553 S\n0.762763 0.237225 0.974448 S\n0.211684 0.237225 0.974447 S\n0.237224 0.211684 0.474447 S\n0.237223 0.762763 0.474446 S\n0.237237 0.762776 0.025553 S\n0.762776 0.237236 0.525552 S\n0.788316 0.762776 0.025552 S\n",
"nsites": 14,
"nelements": 3,
"elements": [
"Al",
"Co",
"S"
],
"chemical_system": "Al-Co-S",
"density": 4.070449049065594,
"density_atomic": 0.06282853846391989,
"volume": 222.828675348539,
"volume_molar": 9.5850403450946,
"formula_full": "Al2 Co4 S8",
"formula_reduced": "Al(CoS2)2",
"formula_anonymous": "AB2C4",
"energy_above_hull": 2.484926371428571,
"spacegroup": 227
}
]
}