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=energy_above_hull&page=991",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=energy_above_hull&page=989",
"results": [
{
"id": "jvasp-55229",
"created_at": "2022-09-04T14:38:35.286110Z",
"updated_at": "2022-09-04T14:38:35.286136Z",
"structure_string": "Tb3 In3 Ni3\n1.0\n3.718165 -6.440051 -0.000000\n3.718165 6.440051 0.000000\n0.000000 0.000000 3.804687\nTb In Ni\n3 3 3\ndirect\n-0.000000 0.589414 0.500000 Tb\n0.589414 -0.000000 0.500000 Tb\n0.410585 0.410585 0.500000 Tb\n0.745587 0.745587 0.000000 In\n-0.000000 0.254412 0.000000 In\n0.254412 -0.000000 0.000000 In\n0.000000 0.000000 0.500000 Ni\n0.666666 0.333332 0.000000 Ni\n0.333332 0.666666 0.000000 Ni\n",
"nsites": 9,
"nelements": 3,
"elements": [
"Tb",
"In",
"Ni"
],
"chemical_system": "In-Ni-Tb",
"density": 9.088924269656243,
"density_atomic": 0.04939416113991482,
"volume": 182.20777096520442,
"volume_molar": 12.192009381314467,
"formula_full": "Tb3 In3 Ni3",
"formula_reduced": "TbInNi",
"formula_anonymous": "ABC",
"energy_above_hull": 0.4035702566666668,
"spacegroup": 189
},
{
"id": "jvasp-56274",
"created_at": "2022-09-04T14:37:49.994023Z",
"updated_at": "2022-09-04T14:37:49.994050Z",
"structure_string": "Sn2 P2 Cl18\n1.0\n6.195717 0.000000 -0.000000\n0.000000 9.708417 -3.194200\n-0.000000 -0.080439 10.220068\nSn P Cl\n2 2 18\ndirect\n0.886466 0.250000 0.750000 Sn\n0.113534 0.750000 0.250000 Sn\n0.500000 0.750000 0.750000 P\n0.500000 0.250000 0.250000 P\n0.874847 0.398793 0.601207 Cl\n0.730384 0.431290 0.931290 Cl\n0.125154 0.601207 0.398793 Cl\n0.729247 0.750000 0.250000 Cl\n0.315201 0.587613 0.723869 Cl\n0.269617 0.931290 0.431290 Cl\n0.269617 0.568710 0.068710 Cl\n0.315201 0.912387 0.776132 Cl\n0.315201 0.276132 0.412387 Cl\n0.270754 0.250000 0.750000 Cl\n0.125154 0.898793 0.101207 Cl\n0.684800 0.412387 0.276132 Cl\n0.684800 0.723869 0.587613 Cl\n0.684800 0.776132 0.912387 Cl\n0.315201 0.223869 0.087613 Cl\n0.730384 0.068710 0.568710 Cl\n0.684800 0.087613 0.223869 Cl\n0.874847 0.101207 0.898793 Cl\n",
"nsites": 22,
"nelements": 3,
"elements": [
"Sn",
"P",
"Cl"
],
"chemical_system": "Cl-P-Sn",
"density": 2.5389997412517897,
"density_atomic": 0.035880211365422285,
"volume": 613.1513489689577,
"volume_molar": 16.78401695761338,
"formula_full": "Sn2 P2 Cl18",
"formula_reduced": "SnPCl9",
"formula_anonymous": "ABC9",
"energy_above_hull": 0.4036039825,
"spacegroup": 67
},
{
"id": "jvasp-115177",
"created_at": "2022-09-04T14:38:45.004705Z",
"updated_at": "2022-09-04T14:38:45.004740Z",
"structure_string": "Li1 Au2\n1.0\n4.187833 0.000000 0.000000\n0.000000 2.720522 0.000000\n0.000000 0.000000 5.527585\nLi Au\n1 2\ndirect\n0.466645 0.000000 0.000000 Li\n-0.033323 0.000000 0.743588 Au\n-0.033323 0.000000 0.256413 Au\n",
"nsites": 3,
"nelements": 2,
"elements": [
"Li",
"Au"
],
"chemical_system": "Au-Li",
"density": 10.570124674674522,
"density_atomic": 0.047636980760008704,
"volume": 62.97628338608947,
"volume_molar": 12.641734769756008,
"formula_full": "Li1 Au2",
"formula_reduced": "LiAu2",
"formula_anonymous": "AB2",
"energy_above_hull": 0.40381838,
"spacegroup": 47
},
{
"id": "jvasp-38473",
"created_at": "2022-09-04T14:37:50.366102Z",
"updated_at": "2022-09-04T14:37:50.366115Z",
"structure_string": "Li3 Hg1\n1.0\n-2.129765 2.129765 3.727538\n2.129765 -2.129765 3.727538\n2.129765 2.129765 -3.727538\nLi Hg\n3 1\ndirect\n0.750001 0.250000 0.500001 Li\n0.250000 0.750001 0.500001 Li\n0.500001 0.500001 0.000000 Li\n0.000000 0.000000 0.000000 Hg\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Li",
"Hg"
],
"chemical_system": "Hg-Li",
"density": 5.436342015971202,
"density_atomic": 0.05914452512001453,
"volume": 67.63094287904593,
"volume_molar": 10.182076443728356,
"formula_full": "Li3 Hg1",
"formula_reduced": "Li3Hg",
"formula_anonymous": "AB3",
"energy_above_hull": 0.4039650000000002,
"spacegroup": 139
},
{
"id": "jvasp-19791",
"created_at": "2022-09-04T14:38:28.903733Z",
"updated_at": "2022-09-04T14:38:28.903757Z",
"structure_string": "Li3 Hg1\n1.0\n3.956131 0.000000 2.284073\n1.318710 3.729876 2.284073\n0.000000 0.000000 4.568146\nLi Hg\n3 1\ndirect\n0.749999 0.750001 0.749999 Li\n0.500000 0.500001 0.500000 Li\n0.250000 0.250000 0.250000 Li\n0.000000 0.000000 0.000000 Hg\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Li",
"Hg"
],
"chemical_system": "Hg-Li",
"density": 5.454402465675957,
"density_atomic": 0.059341013258197066,
"volume": 67.40700538084359,
"volume_molar": 10.148361865337938,
"formula_full": "Li3 Hg1",
"formula_reduced": "Li3Hg",
"formula_anonymous": "AB3",
"energy_above_hull": 0.4040875000000001,
"spacegroup": 225
},
{
"id": "jvasp-93416",
"created_at": "2022-09-04T14:36:33.768831Z",
"updated_at": "2022-09-04T14:36:33.768862Z",
"structure_string": "Ag4 S2\n1.0\n4.042139 0.664121 0.000000\n-0.771843 4.490703 0.000000\n-3.270296 -5.154824 6.520452\nAg S\n4 2\ndirect\n0.596479 0.311567 0.859865 Ag\n0.199517 0.579451 0.298673 Ag\n0.876750 0.591837 0.640135 Ag\n0.602171 -0.017895 0.201327 Ag\n0.940497 0.970476 0.515456 S\n0.909585 0.939565 0.984544 S\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Ag",
"S"
],
"chemical_system": "Ag-S",
"density": 6.762160302356182,
"density_atomic": 0.049300788288378486,
"volume": 121.70190798783557,
"volume_molar": 12.21510034438857,
"formula_full": "Ag4 S2",
"formula_reduced": "Ag2S",
"formula_anonymous": "AB2",
"energy_above_hull": 0.4041108333333333,
"spacegroup": 7
},
{
"id": "jvasp-36483",
"created_at": "2022-09-04T14:37:33.659958Z",
"updated_at": "2022-09-04T14:37:33.659977Z",
"structure_string": "Ba3 Sb2\n1.0\n6.451010 -0.000000 -0.000000\n-0.000000 6.451010 -0.000000\n0.000000 -0.000000 6.451010\nBa Sb\n3 2\ndirect\n0.000000 0.500000 0.500000 Ba\n0.500000 0.000000 0.500000 Ba\n0.500000 0.500000 0.000000 Ba\n0.000000 0.000000 0.000000 Sb\n0.500000 0.500000 0.500000 Sb\n",
"nsites": 5,
"nelements": 2,
"elements": [
"Ba",
"Sb"
],
"chemical_system": "Ba-Sb",
"density": 4.054518727099508,
"density_atomic": 0.01862459591754034,
"volume": 268.46220031496534,
"volume_molar": 32.33434318072075,
"formula_full": "Ba3 Sb2",
"formula_reduced": "Ba3Sb2",
"formula_anonymous": "A2B3",
"energy_above_hull": 0.4041660220000002,
"spacegroup": 221
},
{
"id": "jvasp-30574",
"created_at": "2022-09-04T14:36:46.713622Z",
"updated_at": "2022-09-04T14:36:46.713644Z",
"structure_string": "Mg1 Cr2 F12\n1.0\n4.358642 0.045101 2.878813\n3.102081 8.222809 5.790963\n0.080802 0.075543 5.260293\nMg Cr F\n1 2 12\ndirect\n0.499999 0.750000 0.500000 Mg\n0.007745 0.012420 0.976084 Cr\n-0.007746 0.487579 0.023916 Cr\n0.376043 0.049362 0.762248 F\n0.352401 0.555630 0.771710 F\n0.088692 0.384602 0.374873 F\n0.114738 0.884480 0.352684 F\n0.224753 0.317614 0.911622 F\n0.235902 0.821064 0.884848 F\n0.911307 0.115398 0.625126 F\n0.885261 0.615520 0.647315 F\n0.623956 0.450637 0.237752 F\n0.647598 0.944370 0.228289 F\n0.775246 0.182385 0.088378 F\n0.764097 0.678936 0.115151 F\n",
"nsites": 15,
"nelements": 3,
"elements": [
"Mg",
"Cr",
"F"
],
"chemical_system": "Cr-F-Mg",
"density": 3.2036146223015827,
"density_atomic": 0.0812256838350276,
"volume": 184.67065208666708,
"volume_molar": 7.414084407379312,
"formula_full": "Mg1 Cr2 F12",
"formula_reduced": "MgCr2F12",
"formula_anonymous": "AB2C12",
"energy_above_hull": 0.4042171493333332,
"spacegroup": 2
},
{
"id": "jvasp-110853",
"created_at": "2022-09-04T14:38:37.969131Z",
"updated_at": "2022-09-04T14:38:37.969165Z",
"structure_string": "Pr1 Ho1 In2\n1.0\n4.666038 -0.000000 2.693938\n1.555346 4.399182 2.693938\n-0.000000 -0.000000 5.387876\nPr Ho In\n1 1 2\ndirect\n0.000000 0.000000 0.000000 Pr\n0.500001 0.500000 0.500000 Ho\n0.250000 0.250000 0.250000 In\n0.750001 0.750000 0.750001 In\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Pr",
"Ho",
"In"
],
"chemical_system": "Ho-In-Pr",
"density": 8.039881885162455,
"density_atomic": 0.03616780880904777,
"volume": 110.59558573532817,
"volume_molar": 16.65055461831986,
"formula_full": "Pr1 Ho1 In2",
"formula_reduced": "PrHoIn2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.4042863391666666,
"spacegroup": 225
},
{
"id": "jvasp-19697",
"created_at": "2022-09-04T14:38:20.028823Z",
"updated_at": "2022-09-04T14:38:20.028834Z",
"structure_string": "Zr2 Zn4\n1.0\n4.531734 -0.000000 2.616397\n1.510578 4.272560 2.616397\n-0.000000 0.000000 5.232795\nZr Zn\n2 4\ndirect\n0.875000 0.875000 0.875000 Zr\n0.125000 0.125000 0.125000 Zr\n0.500000 0.500000 0.500000 Zn\n0.500000 0.500000 0.000001 Zn\n0.000000 0.500000 0.500000 Zn\n0.500000 0.000000 0.500000 Zn\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Zr",
"Zn"
],
"chemical_system": "Zn-Zr",
"density": 7.278265972334258,
"density_atomic": 0.059219528993517616,
"volume": 101.31792842622544,
"volume_molar": 10.169180441572248,
"formula_full": "Zr2 Zn4",
"formula_reduced": "ZrZn2",
"formula_anonymous": "AB2",
"energy_above_hull": 0.4043760555555559,
"spacegroup": 227
},
{
"id": "jvasp-8303",
"created_at": "2022-09-04T14:37:06.563220Z",
"updated_at": "2022-09-04T14:37:06.563240Z",
"structure_string": "Al1 V1 F5\n1.0\n3.346924 -0.000000 1.230801\n1.352739 4.842073 1.487547\n-0.028120 0.059467 5.242523\nAl V F\n1 1 5\ndirect\n0.500000 0.500000 0.500000 Al\n0.000000 0.000000 0.000000 V\n0.500000 0.798360 0.201640 F\n0.499999 0.201640 0.798360 F\n0.734323 0.265677 0.265677 F\n0.265677 0.734323 0.734323 F\n0.000000 0.500000 0.500000 F\n",
"nsites": 7,
"nelements": 3,
"elements": [
"Al",
"V",
"F"
],
"chemical_system": "Al-F-V",
"density": 3.38076564128459,
"density_atomic": 0.08241973283219425,
"volume": 84.93111733632927,
"volume_molar": 7.306673478620731,
"formula_full": "Al1 V1 F5",
"formula_reduced": "AlVF5",
"formula_anonymous": "ABC5",
"energy_above_hull": 0.4044512017857141,
"spacegroup": 71
},
{
"id": "jvasp-109584",
"created_at": "2022-09-04T14:38:20.733330Z",
"updated_at": "2022-09-04T14:38:20.733356Z",
"structure_string": "Pr1 Dy1 In2\n1.0\n4.673879 -0.000000 2.698465\n1.557960 4.406575 2.698465\n-0.000000 -0.000000 5.396930\nPr Dy In\n1 1 2\ndirect\n0.000000 0.000000 0.000000 Pr\n0.500000 0.500001 0.500001 Dy\n0.250000 0.250000 0.250000 In\n0.750000 0.750001 0.750001 In\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Pr",
"Dy",
"In"
],
"chemical_system": "Dy-In-Pr",
"density": 7.963178580566732,
"density_atomic": 0.03598608281011299,
"volume": 111.15408201294694,
"volume_molar": 16.734638198263767,
"formula_full": "Pr1 Dy1 In2",
"formula_reduced": "PrDyIn2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.4044815724999999,
"spacegroup": 225
}
]
}