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=-structure_string&page=113",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-structure_string&page=111",
"results": [
{
"id": "jvasp-9516",
"created_at": "2022-09-04T14:37:15.774937Z",
"updated_at": "2022-09-04T14:37:15.774967Z",
"structure_string": "Zn2 Fe2 P2 O10\n1.0\n5.148941 -0.239037 -0.151130\n-0.907486 5.501986 0.131297\n-2.047597 -2.154808 6.287172\nZn Fe P O\n2 2 2 10\ndirect\n0.274505 0.164772 0.785523 Zn\n0.733990 0.825066 0.243622 Zn\n0.004259 0.494905 0.514549 Fe\n0.004244 0.494931 0.014549 Fe\n0.669418 0.846638 0.748590 P\n0.339079 0.143207 0.280515 P\n0.742659 0.720458 0.926216 O\n0.906207 0.864188 0.651088 O\n0.265833 0.269410 0.102902 O\n0.102282 0.125660 0.378013 O\n0.627841 0.290396 0.463865 O\n0.353953 0.865196 0.179562 O\n0.380661 0.699434 0.565239 O\n0.654541 0.124652 0.849532 O\n0.885470 0.536058 0.251994 O\n0.123031 0.453777 0.777110 O\n",
"nsites": 16,
"nelements": 4,
"elements": [
"Zn",
"Fe",
"P",
"O"
],
"chemical_system": "Fe-O-P-Zn",
"density": 4.375292720561643,
"density_atomic": 0.09076940257914815,
"volume": 176.27085279148432,
"volume_molar": 6.634549296222234,
"formula_full": "Zn2 Fe2 P2 O10",
"formula_reduced": "ZnFePO5",
"formula_anonymous": "ABCD5",
"energy_above_hull": 2.2296548625,
"spacegroup": 2
},
{
"id": "jvasp-46371",
"created_at": "2022-09-04T14:36:14.311356Z",
"updated_at": "2022-09-04T14:36:14.311382Z",
"structure_string": "Zn2 Fe2 O6\n1.0\n2.479557 1.431573 4.588906\n-2.479556 1.431573 4.588906\n-0.000000 -2.863145 4.588906\nZn Fe O\n2 2 6\ndirect\n0.366857 0.366857 0.366858 Zn\n0.633143 0.633143 0.633145 Zn\n0.159599 0.159599 0.159599 Fe\n0.840401 0.840401 0.840404 Fe\n0.048045 0.786282 0.437530 O\n0.562471 0.951955 0.213720 O\n0.213718 0.562472 0.951956 O\n0.786282 0.437528 0.048047 O\n0.437528 0.048045 0.786283 O\n0.951954 0.213718 0.562474 O\n",
"nsites": 10,
"nelements": 3,
"elements": [
"Zn",
"Fe",
"O"
],
"chemical_system": "Fe-O-Zn",
"density": 5.75129437563725,
"density_atomic": 0.10231803277668765,
"volume": 97.73448265786459,
"volume_molar": 5.885708116714396,
"formula_full": "Zn2 Fe2 O6",
"formula_reduced": "ZnFeO3",
"formula_anonymous": "ABC3",
"energy_above_hull": 1.64546328,
"spacegroup": 148
},
{
"id": "jvasp-9539",
"created_at": "2022-09-04T14:37:28.448639Z",
"updated_at": "2022-09-04T14:37:28.448647Z",
"structure_string": "Zn2 Fe2 F8\n1.0\n-5.079452 0.007154 0.148803\n-0.008020 -5.254197 -0.007406\n2.359142 2.616262 5.071554\nZn Fe F\n2 2 8\ndirect\n0.265343 0.221392 0.509496 Zn\n0.765408 0.788740 0.509546 Zn\n-0.014866 0.531051 0.018886 Fe\n0.485176 -0.011476 0.018949 Fe\n0.366411 0.824175 0.263992 F\n0.179851 0.547109 0.771155 F\n0.684621 0.203602 0.708390 F\n0.679921 0.724770 0.771248 F\n0.766978 0.424141 0.216134 F\n0.866431 0.940408 0.264019 F\n0.266979 0.292613 0.216120 F\n0.184656 0.005505 0.708446 F\n",
"nsites": 12,
"nelements": 3,
"elements": [
"Zn",
"Fe",
"F"
],
"chemical_system": "F-Fe-Zn",
"density": 4.7782551139503715,
"density_atomic": 0.08753056470960681,
"volume": 137.094968366895,
"volume_molar": 6.880043308276574,
"formula_full": "Zn2 Fe2 F8",
"formula_reduced": "ZnFeF4",
"formula_anonymous": "ABC4",
"energy_above_hull": 0.0,
"spacegroup": 9
},
{
"id": "jvasp-99900",
"created_at": "2022-09-04T14:36:20.632611Z",
"updated_at": "2022-09-04T14:36:20.632635Z",
"structure_string": "Zn2 Fe1 S3\n1.0\n3.813921 0.000000 -0.000000\n-1.906961 3.302953 -0.000000\n-0.000000 0.000000 9.399401\nZn Fe S\n2 1 3\ndirect\n0.666667 0.333333 0.333178 Zn\n0.333333 0.666666 0.668792 Zn\n0.000000 0.000000 -0.001100 Fe\n0.000000 0.000000 0.246397 S\n0.666667 0.333333 0.583373 S\n0.333333 0.666666 0.919361 S\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Zn",
"Fe",
"S"
],
"chemical_system": "Fe-S-Zn",
"density": 3.96682735002078,
"density_atomic": 0.05067304304074492,
"volume": 118.40615127801878,
"volume_molar": 11.884308497434716,
"formula_full": "Zn2 Fe1 S3",
"formula_reduced": "Zn2FeS3",
"formula_anonymous": "AB2C3",
"energy_above_hull": 0.99655105,
"spacegroup": 156
},
{
"id": "jvasp-75516",
"created_at": "2022-09-04T14:35:49.113507Z",
"updated_at": "2022-09-04T14:35:49.113540Z",
"structure_string": "Zn2 Fe1 As1\n1.0\n-0.000000 3.123299 3.123299\n3.123299 -0.000000 3.123299\n3.123299 3.123299 0.000000\nZn Fe As\n2 1 1\ndirect\n0.000000 0.000000 0.000000 Zn\n0.750000 0.750000 0.750000 Zn\n0.250000 0.250000 0.250000 Fe\n0.500000 0.500000 0.500000 As\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Zn",
"Fe",
"As"
],
"chemical_system": "As-Fe-Zn",
"density": 7.1283758138248405,
"density_atomic": 0.06564313427605108,
"volume": 60.935542522675384,
"volume_molar": 9.174060358962917,
"formula_full": "Zn2 Fe1 As1",
"formula_reduced": "Zn2FeAs",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.7282145124999999,
"spacegroup": 216
},
{
"id": "jvasp-2154",
"created_at": "2022-09-04T14:35:42.679069Z",
"updated_at": "2022-09-04T14:35:42.679091Z",
"structure_string": "Zn2 F4\n1.0\n4.745809 0.000000 0.000000\n0.000000 4.745809 0.000000\n0.000000 0.000000 3.179803\nZn F\n2 4\ndirect\n0.500000 0.500000 0.499999 Zn\n0.000000 0.000000 0.000000 Zn\n0.696844 0.696844 0.000000 F\n0.196843 0.803157 0.499999 F\n0.303157 0.303157 0.000000 F\n0.803157 0.196843 0.499999 F\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Zn",
"F"
],
"chemical_system": "F-Zn",
"density": 4.795162098993239,
"density_atomic": 0.08377810340387323,
"volume": 71.6177587725459,
"volume_molar": 7.188203737399937,
"formula_full": "Zn2 F4",
"formula_reduced": "ZnF2",
"formula_anonymous": "AB2",
"energy_above_hull": 0.0,
"spacegroup": 136
},
{
"id": "jvasp-7079",
"created_at": "2022-09-04T14:38:32.235935Z",
"updated_at": "2022-09-04T14:38:32.235954Z",
"structure_string": "Zn2 Cu4 Sn2 Se8\n1.0\n5.756358 -0.000000 0.000000\n0.000000 5.756358 -0.000000\n-0.000000 -0.000000 11.508753\nZn Cu Sn Se\n2 4 2 8\ndirect\n0.500000 0.500000 0.000000 Zn\n0.000000 0.000000 0.500000 Zn\n0.000000 0.000000 0.000000 Cu\n0.500000 0.500000 0.500000 Cu\n-0.000000 0.500000 0.750000 Cu\n0.500000 0.000000 0.250000 Cu\n0.500000 0.000000 0.750000 Sn\n-0.000000 0.500000 0.250000 Sn\n0.768210 0.260068 0.880322 Se\n0.231791 0.739932 0.880322 Se\n0.260068 0.231791 0.119677 Se\n0.739932 0.768210 0.119677 Se\n0.268209 0.760068 0.380323 Se\n0.731791 0.239932 0.380323 Se\n0.760068 0.731791 0.619677 Se\n0.239932 0.268209 0.619677 Se\n",
"nsites": 16,
"nelements": 4,
"elements": [
"Zn",
"Cu",
"Sn",
"Se"
],
"chemical_system": "Cu-Se-Sn-Zn",
"density": 5.460822960437328,
"density_atomic": 0.041956197559124414,
"volume": 381.35009678731967,
"volume_molar": 14.353399760580393,
"formula_full": "Zn2 Cu4 Sn2 Se8",
"formula_reduced": "ZnCu2SnSe4",
"formula_anonymous": "ABC2D4",
"energy_above_hull": 0.4689470583333333,
"spacegroup": 82
},
{
"id": "jvasp-7076",
"created_at": "2022-09-04T14:38:29.858550Z",
"updated_at": "2022-09-04T14:38:29.858574Z",
"structure_string": "Zn2 Cu4 Sn2 S8\n1.0\n5.466544 0.000000 0.000000\n-0.000000 5.466544 0.000000\n0.000000 -0.000000 10.926878\nZn Cu Sn S\n2 4 2 8\ndirect\n0.000000 0.500000 0.250000 Zn\n0.500000 -0.000000 0.750000 Zn\n0.000000 0.000000 0.000000 Cu\n0.500000 0.500000 0.500000 Cu\n0.500000 -0.000000 0.250000 Cu\n0.000000 0.500000 0.750000 Cu\n0.000000 0.000000 0.500000 Sn\n0.500000 0.500000 0.000000 Sn\n0.241420 0.234707 0.129472 S\n0.758579 0.765293 0.129472 S\n0.234707 0.758579 0.870528 S\n0.765293 0.241420 0.870528 S\n0.741419 0.734706 0.629473 S\n0.258580 0.265293 0.629473 S\n0.734706 0.258580 0.370528 S\n0.265293 0.741419 0.370528 S\n",
"nsites": 16,
"nelements": 4,
"elements": [
"Zn",
"Cu",
"Sn",
"S"
],
"chemical_system": "Cu-S-Sn-Zn",
"density": 4.469794170553366,
"density_atomic": 0.04900023832762938,
"volume": 326.5290240635056,
"volume_molar": 12.29002340709911,
"formula_full": "Zn2 Cu4 Sn2 S8",
"formula_reduced": "ZnCu2SnS4",
"formula_anonymous": "ABC2D4",
"energy_above_hull": 0.746049125,
"spacegroup": 82
},
{
"id": "jvasp-10030",
"created_at": "2022-09-04T14:37:28.700919Z",
"updated_at": "2022-09-04T14:37:28.700936Z",
"structure_string": "Zn2 Cu4 O8\n1.0\n5.917433 0.007864 0.014413\n2.965527 5.120714 0.014413\n2.972754 1.716320 4.854487\nZn Cu O\n2 4 8\ndirect\n0.125000 0.624999 0.625000 Zn\n0.625000 0.124999 0.625000 Zn\n0.992289 0.992287 0.007711 Cu\n0.257712 0.257712 0.242288 Cu\n0.625001 0.624999 0.124999 Cu\n0.625000 0.624999 0.625000 Cu\n0.394944 0.394943 0.367137 O\n0.393452 0.859575 0.373486 O\n0.394944 0.394943 0.842976 O\n0.859576 0.393450 0.373486 O\n0.390425 0.856548 0.876513 O\n0.856549 0.390424 0.876513 O\n0.855057 0.855055 0.407023 O\n0.855057 0.855055 0.882862 O\n",
"nsites": 14,
"nelements": 3,
"elements": [
"Zn",
"Cu",
"O"
],
"chemical_system": "Cu-O-Zn",
"density": 5.80704437061849,
"density_atomic": 0.09543750737064735,
"volume": 146.69285049146018,
"volume_molar": 6.310035672465775,
"formula_full": "Zn2 Cu4 O8",
"formula_reduced": "Zn(CuO2)2",
"formula_anonymous": "AB2C4",
"energy_above_hull": 1.0661121857142857,
"spacegroup": 74
},
{
"id": "jvasp-9901",
"created_at": "2022-09-04T14:38:11.447778Z",
"updated_at": "2022-09-04T14:38:11.447811Z",
"structure_string": "Zn2 Cu4 O8\n1.0\n5.897667 0.064346 0.005295\n-0.346525 5.887880 -0.005867\n-2.779575 -2.971965 4.270300\nZn Cu O\n2 4 8\ndirect\n0.875027 0.624989 0.750001 Zn\n0.124979 0.375014 0.250004 Zn\n0.500003 0.000003 0.000004 Cu\n-0.000002 -0.000000 0.499999 Cu\n0.500001 -0.000005 0.500000 Cu\n0.500001 0.499998 -0.000001 Cu\n0.718744 0.175480 0.938181 O\n0.324473 0.262715 0.043234 O\n0.219478 0.781252 0.456773 O\n0.762717 0.719430 0.438195 O\n0.780517 0.218748 0.543226 O\n0.675525 0.737283 0.956764 O\n0.237276 0.280572 0.561805 O\n0.281257 0.824522 0.061820 O\n",
"nsites": 14,
"nelements": 3,
"elements": [
"Zn",
"Cu",
"O"
],
"chemical_system": "Cu-O-Zn",
"density": 5.741376772137575,
"density_atomic": 0.09435827471560781,
"volume": 148.37066534117392,
"volume_molar": 6.38220736671002,
"formula_full": "Zn2 Cu4 O8",
"formula_reduced": "Zn(CuO2)2",
"formula_anonymous": "AB2C4",
"energy_above_hull": 1.0577664714285713,
"spacegroup": 88
},
{
"id": "jvasp-58134",
"created_at": "2022-09-04T14:36:57.123588Z",
"updated_at": "2022-09-04T14:36:57.123614Z",
"structure_string": "Zn2 Cu4 O8\n1.0\n5.247204 0.000000 -2.754850\n-1.446331 5.043937 -2.754850\n-0.241686 -0.320728 5.914299\nZn Cu O\n2 4 8\ndirect\n0.374999 0.625000 0.750000 Zn\n0.624999 0.375000 0.250000 Zn\n-0.000000 -0.000000 0.500000 Cu\n0.000000 0.500000 0.000000 Cu\n0.499999 -0.000000 0.500000 Cu\n0.000000 0.000000 0.000000 Cu\n0.761001 0.782885 0.522005 O\n0.760877 0.238997 0.977994 O\n0.217114 0.238997 0.977994 O\n0.238997 0.217115 0.477994 O\n0.238997 0.760879 0.477994 O\n0.239121 0.761003 0.022006 O\n0.761001 0.239121 0.522005 O\n0.782884 0.761003 0.022006 O\n",
"nsites": 14,
"nelements": 3,
"elements": [
"Zn",
"Cu",
"O"
],
"chemical_system": "Cu-O-Zn",
"density": 5.784727859879827,
"density_atomic": 0.09507074038521077,
"volume": 147.25876692738836,
"volume_molar": 6.3343787327197525,
"formula_full": "Zn2 Cu4 O8",
"formula_reduced": "Zn(CuO2)2",
"formula_anonymous": "AB2C4",
"energy_above_hull": 1.0584679,
"spacegroup": 227
},
{
"id": "jvasp-9885",
"created_at": "2022-09-04T14:38:08.688903Z",
"updated_at": "2022-09-04T14:38:08.688931Z",
"structure_string": "Zn2 Cu4 O8\n1.0\n4.858651 0.000000 -2.550854\n-1.339230 4.670433 -2.550853\n0.310037 0.411435 6.493134\nZn Cu O\n2 4 8\ndirect\n0.375000 0.624999 0.750000 Zn\n0.625000 0.375000 0.250000 Zn\n0.000000 -0.000000 0.500000 Cu\n-0.000000 0.500000 0.000000 Cu\n0.500000 -0.000000 0.500000 Cu\n0.000000 0.000000 0.000000 Cu\n0.749805 0.771777 0.499609 O\n0.772170 0.250195 0.000391 O\n0.228222 0.250195 0.000391 O\n0.250195 0.228221 0.500390 O\n0.250195 0.772169 0.500390 O\n0.227830 0.749803 0.999609 O\n0.749805 0.227829 0.499609 O\n0.771779 0.749803 0.999609 O\n",
"nsites": 14,
"nelements": 3,
"elements": [
"Zn",
"Cu",
"O"
],
"chemical_system": "Cu-O-Zn",
"density": 5.4071890049365825,
"density_atomic": 0.08886597166781346,
"volume": 157.5406169228968,
"volume_molar": 6.776655503763732,
"formula_full": "Zn2 Cu4 O8",
"formula_reduced": "Zn(CuO2)2",
"formula_anonymous": "AB2C4",
"energy_above_hull": 1.0531293285714285,
"spacegroup": 141
}
]
}