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=-density_atomic&page=3888",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-density_atomic&page=3886",
"results": [
{
"id": "jvasp-102207",
"created_at": "2022-09-04T14:36:34.428766Z",
"updated_at": "2022-09-04T14:36:34.428784Z",
"structure_string": "In3 Cu1 Se5\n1.0\n5.299220 -0.001973 2.331004\n2.604646 6.525799 1.202020\n0.006697 0.007949 7.150026\nIn Cu Se\n3 1 5\ndirect\n0.811376 0.813682 0.585644 In\n0.625635 0.593514 0.202540 In\n0.402777 0.379752 0.805066 In\n0.965761 0.017329 0.006221 Cu\n0.065695 0.266416 0.127105 Se\n0.897719 0.107970 0.684717 Se\n0.616323 0.934477 0.295327 Se\n0.420542 0.719552 0.905675 Se\n0.244176 0.467312 0.487702 Se\n",
"nsites": 9,
"nelements": 3,
"elements": [
"In",
"Cu",
"Se"
],
"chemical_system": "Cu-In-Se",
"density": 5.392892965888449,
"density_atomic": 0.03640892438948138,
"volume": 247.19214178708668,
"volume_molar": 16.540287473419045,
"formula_full": "In3 Cu1 Se5",
"formula_reduced": "In3CuSe5",
"formula_anonymous": "AB3C5",
"energy_above_hull": 0.6119963548148147,
"spacegroup": 1
},
{
"id": "jvasp-8124",
"created_at": "2022-09-04T14:36:46.141068Z",
"updated_at": "2022-09-04T14:36:46.141099Z",
"structure_string": "K1 Ce1 S2\n1.0\n4.042086 0.019101 6.523766\n1.871660 3.582696 6.523766\n0.031361 0.019101 7.674438\nK Ce S\n1 1 2\ndirect\n0.500000 0.500000 0.500000 K\n0.000000 0.000000 0.000000 Ce\n0.736617 0.736618 0.736617 S\n0.263383 0.263383 0.263383 S\n",
"nsites": 4,
"nelements": 3,
"elements": [
"K",
"Ce",
"S"
],
"chemical_system": "Ce-K-S",
"density": 3.678027639389408,
"density_atomic": 0.0364086607678552,
"volume": 109.8639696061426,
"volume_molar": 16.540407235513815,
"formula_full": "K1 Ce1 S2",
"formula_reduced": "KCeS2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.7723283750000002,
"spacegroup": 166
},
{
"id": "jvasp-93256",
"created_at": "2022-09-04T14:36:31.889935Z",
"updated_at": "2022-09-04T14:36:31.889954Z",
"structure_string": "Cd1 H1 Cl3\n1.0\n5.159493 -0.000000 0.000000\n-0.000000 5.159493 -0.000000\n0.000000 0.000000 5.159493\nCd H Cl\n1 1 3\ndirect\n0.500000 0.500000 0.500000 Cd\n0.000000 0.000000 0.000000 H\n0.000000 0.500000 0.500000 Cl\n0.500000 0.500000 0.000000 Cl\n0.500000 0.000000 0.500000 Cl\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Cd",
"H",
"Cl"
],
"chemical_system": "Cd-Cl-H",
"density": 2.65712578057276,
"density_atomic": 0.036403984569979675,
"volume": 137.34760244138823,
"volume_molar": 16.54253189901119,
"formula_full": "Cd1 H1 Cl3",
"formula_reduced": "CdHCl3",
"formula_anonymous": "ABC3",
"energy_above_hull": 0.2261583905000002,
"spacegroup": 221
},
{
"id": "jvasp-40289",
"created_at": "2022-09-04T14:37:51.257120Z",
"updated_at": "2022-09-04T14:37:51.257152Z",
"structure_string": "Pm4 S6\n1.0\n-7.117361 -0.000000 -0.000000\n3.558681 -6.163816 0.000000\n-3.558681 2.054605 6.261808\nPm S\n4 6\ndirect\n0.646592 0.353411 0.060227 Pm\n0.853408 0.146591 0.439774 Pm\n0.146591 0.853409 0.560227 Pm\n0.353409 0.646592 0.939774 Pm\n0.250000 0.047263 0.250001 S\n0.952737 0.452739 0.250001 S\n0.547262 0.749999 0.250001 S\n0.452737 0.250000 0.750001 S\n0.047262 0.547262 0.750001 S\n0.750000 0.952740 0.750001 S\n",
"nsites": 10,
"nelements": 2,
"elements": [
"Pm",
"S"
],
"chemical_system": "Pm-S",
"density": 4.668929676845403,
"density_atomic": 0.03640253203979977,
"volume": 274.70616574327187,
"volume_molar": 16.543191977458733,
"formula_full": "Pm4 S6",
"formula_reduced": "Pm2S3",
"formula_anonymous": "A2B3",
"energy_above_hull": 1.45420647,
"spacegroup": 167
},
{
"id": "jvasp-14976",
"created_at": "2022-09-04T14:36:09.863670Z",
"updated_at": "2022-09-04T14:36:09.863716Z",
"structure_string": "Nd1 As1\n1.0\n3.695462 0.000000 2.133575\n1.231820 3.484115 2.133575\n0.000000 0.000000 4.267152\nNd As\n1 1\ndirect\n0.499999 0.500001 0.500001 Nd\n0.000000 0.000000 0.000000 As\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Nd",
"As"
],
"chemical_system": "As-Nd",
"density": 6.623967421202058,
"density_atomic": 0.03640245388734105,
"volume": 54.941351102033806,
"volume_molar": 16.543227494051436,
"formula_full": "Nd1 As1",
"formula_reduced": "NdAs",
"formula_anonymous": "AB",
"energy_above_hull": 0.5346016250000001,
"spacegroup": 225
},
{
"id": "jvasp-51226",
"created_at": "2022-09-04T14:37:05.874914Z",
"updated_at": "2022-09-04T14:37:05.874932Z",
"structure_string": "Ir1 Pb1 Br1\n1.0\n0.000000 3.453984 3.453984\n3.453984 -0.000000 3.453984\n3.453984 3.453984 -0.000000\nIr Pb Br\n1 1 1\ndirect\n0.499999 0.499999 0.499999 Ir\n0.250000 0.250000 0.250000 Pb\n0.000000 0.000000 0.000000 Br\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Ir",
"Pb",
"Br"
],
"chemical_system": "Br-Ir-Pb",
"density": 9.657942027521171,
"density_atomic": 0.03640242323729921,
"volume": 82.41209604216935,
"volume_molar": 16.54324142308609,
"formula_full": "Ir1 Pb1 Br1",
"formula_reduced": "IrPbBr",
"formula_anonymous": "ABC",
"energy_above_hull": 1.7339086749999997,
"spacegroup": 216
},
{
"id": "jvasp-2781",
"created_at": "2022-09-04T14:37:07.430097Z",
"updated_at": "2022-09-04T14:37:07.430116Z",
"structure_string": "Sr4 As2 O1\n1.0\n4.670831 -0.000000 -1.322501\n-0.374453 4.655798 -1.322501\n-0.016124 -0.017472 8.852567\nSr As O\n4 2 1\ndirect\n0.673282 0.673282 0.346564 Sr\n0.326719 0.326719 0.653437 Sr\n0.000000 0.500000 0.000000 Sr\n0.500000 0.000000 0.000000 Sr\n0.863896 0.863896 0.727792 As\n0.136105 0.136105 0.272209 As\n0.500000 0.500000 0.000000 O\n",
"nsites": 7,
"nelements": 3,
"elements": [
"Sr",
"As",
"O"
],
"chemical_system": "As-O-Sr",
"density": 4.458614941370174,
"density_atomic": 0.03640221200194312,
"volume": 192.29600661702494,
"volume_molar": 16.54333742048022,
"formula_full": "Sr4 As2 O1",
"formula_reduced": "Sr4As2O",
"formula_anonymous": "AB2C4",
"energy_above_hull": 0.5273088914285715,
"spacegroup": 139
},
{
"id": "jvasp-106590",
"created_at": "2022-09-04T14:36:58.287732Z",
"updated_at": "2022-09-04T14:36:58.287764Z",
"structure_string": "Pu6 Th2\n1.0\n6.815918 -0.000000 0.000000\n-3.407959 5.902759 0.000000\n-0.000000 -0.000000 5.462491\nPu Th\n6 2\ndirect\n0.162687 0.325375 0.250000 Pu\n0.674625 0.837313 0.250000 Pu\n0.162687 0.837313 0.250000 Pu\n0.837313 0.674625 0.750000 Pu\n0.325375 0.162687 0.750000 Pu\n0.837313 0.162687 0.750000 Pu\n0.333333 0.666667 0.750000 Th\n0.666667 0.333333 0.250000 Th\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Pu",
"Th"
],
"chemical_system": "Pu-Th",
"density": 14.568107240881233,
"density_atomic": 0.03640154723421606,
"volume": 219.77087810378308,
"volume_molar": 16.543639536122296,
"formula_full": "Pu6 Th2",
"formula_reduced": "Pu3Th",
"formula_anonymous": "AB3",
"energy_above_hull": 6.8039339,
"spacegroup": 194
},
{
"id": "jvasp-101720",
"created_at": "2022-09-04T14:36:42.763630Z",
"updated_at": "2022-09-04T14:36:42.763648Z",
"structure_string": "Ga1 Ag1 Sn1 Se4\n1.0\n5.377381 0.080614 -4.359982\n-1.172184 5.248687 -4.359982\n-0.063610 -0.080614 6.922545\nGa Ag Sn Se\n1 1 1 4\ndirect\n0.500000 0.500000 0.000000 Ga\n0.250001 0.750001 0.500001 Ag\n0.750000 0.250000 0.500000 Sn\n0.659528 0.650163 0.520769 Se\n0.129394 0.138760 0.479232 Se\n0.861241 0.340472 0.990635 Se\n0.349838 0.870606 0.009366 Se\n",
"nsites": 7,
"nelements": 4,
"elements": [
"Ga",
"Ag",
"Sn",
"Se"
],
"chemical_system": "Ag-Ga-Se-Sn",
"density": 5.285873900968978,
"density_atomic": 0.03640106837698921,
"volume": 192.30204804716726,
"volume_molar": 16.543857168233203,
"formula_full": "Ga1 Ag1 Sn1 Se4",
"formula_reduced": "GaAgSnSe4",
"formula_anonymous": "ABCD4",
"energy_above_hull": 0.8018863930952382,
"spacegroup": 82
},
{
"id": "jvasp-79202",
"created_at": "2022-09-04T14:36:39.713942Z",
"updated_at": "2022-09-04T14:36:39.713965Z",
"structure_string": "K1 Ce1 S2\n1.0\n-2.086251 -3.613493 0.000000\n2.086251 -3.613493 0.000000\n-0.000000 -2.408995 7.288310\nK Ce S\n1 1 2\ndirect\n0.500000 0.500000 0.500000 K\n0.000000 0.000000 0.000000 Ce\n0.263399 0.263399 0.209804 S\n0.736601 0.736601 0.790196 S\n",
"nsites": 4,
"nelements": 3,
"elements": [
"K",
"Ce",
"S"
],
"chemical_system": "Ce-K-S",
"density": 3.6772204575799563,
"density_atomic": 0.03640067050471427,
"volume": 109.8880857011125,
"volume_molar": 16.54403799847607,
"formula_full": "K1 Ce1 S2",
"formula_reduced": "KCeS2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.7723333750000001,
"spacegroup": 166
},
{
"id": "jvasp-85270",
"created_at": "2022-09-04T14:37:19.799388Z",
"updated_at": "2022-09-04T14:37:19.799416Z",
"structure_string": "Ca4 Cl8\n1.0\n6.239412 -0.000000 0.000000\n0.000000 6.909302 0.000000\n0.000000 0.000000 7.647112\nCa Cl\n4 8\ndirect\n0.000000 0.250000 0.152245 Ca\n0.500000 0.250000 0.652245 Ca\n0.000000 0.750000 0.847754 Ca\n0.500000 0.750000 0.347755 Ca\n0.241265 0.422873 0.893091 Cl\n0.741265 0.577126 0.606908 Cl\n0.758735 0.577126 0.106909 Cl\n0.241265 0.922873 0.106909 Cl\n0.741265 0.077126 0.393091 Cl\n0.258735 0.422873 0.393091 Cl\n0.258735 0.922873 0.606908 Cl\n0.758735 0.077126 0.893091 Cl\n",
"nsites": 12,
"nelements": 2,
"elements": [
"Ca",
"Cl"
],
"chemical_system": "Ca-Cl",
"density": 2.2361151885549555,
"density_atomic": 0.036400383187771695,
"volume": 329.6668592222751,
"volume_molar": 16.544168584530375,
"formula_full": "Ca4 Cl8",
"formula_reduced": "CaCl2",
"formula_anonymous": "AB2",
"energy_above_hull": 0.0,
"spacegroup": 60
},
{
"id": "jvasp-18334",
"created_at": "2022-09-04T14:38:08.843975Z",
"updated_at": "2022-09-04T14:38:08.843994Z",
"structure_string": "Ho6 Mn1 Bi2\n1.0\n4.117591 -7.131877 -0.000000\n4.117591 7.131877 0.000000\n-0.000000 -0.000000 4.210231\nHo Mn Bi\n6 1 2\ndirect\n-0.000000 0.768052 0.000000 Ho\n0.390567 -0.000000 0.500000 Ho\n0.609433 0.609433 0.500000 Ho\n0.231948 0.231948 0.000000 Ho\n0.768052 -0.000000 0.000000 Ho\n-0.000000 0.390567 0.500000 Ho\n0.000000 0.000000 0.500000 Mn\n0.333333 0.666667 0.000000 Bi\n0.666667 0.333333 0.000000 Bi\n",
"nsites": 9,
"nelements": 3,
"elements": [
"Ho",
"Mn",
"Bi"
],
"chemical_system": "Bi-Ho-Mn",
"density": 9.82101308074255,
"density_atomic": 0.03639649296763534,
"volume": 247.27657161922227,
"volume_molar": 16.54593689934642,
"formula_full": "Ho6 Mn1 Bi2",
"formula_reduced": "Ho6MnBi2",
"formula_anonymous": "AB2C6",
"energy_above_hull": 1.852766582375479,
"spacegroup": 189
}
]
}