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=-formula_anonymous&page=702",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-formula_anonymous&page=700",
"results": [
{
"id": "jvasp-27139",
"created_at": "2022-09-04T14:38:32.430312Z",
"updated_at": "2022-09-04T14:38:32.430343Z",
"structure_string": "Mg2 V2 O6\n1.0\n4.681248 0.000000 -2.418952\n0.000000 5.254612 0.000000\n0.006138 0.000000 5.751022\nMg V O\n2 2 6\ndirect\n0.575317 0.012821 0.150634 Mg\n0.424683 0.512821 0.849366 Mg\n0.929266 0.012802 0.858529 V\n0.070735 0.512801 0.141471 V\n0.237692 0.262812 -0.000017 O\n0.762309 0.762811 0.000018 O\n0.762291 0.262812 -0.000017 O\n0.237709 0.762811 0.000017 O\n0.765587 0.012756 0.531172 O\n0.234414 0.512756 0.468829 O\n",
"nsites": 10,
"nelements": 3,
"elements": [
"Mg",
"V",
"O"
],
"chemical_system": "Mg-O-V",
"density": 2.8917488060264924,
"density_atomic": 0.07065017140076432,
"volume": 141.5424733122702,
"volume_molar": 8.523886978050347,
"formula_full": "Mg2 V2 O6",
"formula_reduced": "MgVO3",
"formula_anonymous": "ABC3",
"energy_above_hull": 1.7412007500000002,
"spacegroup": 63
},
{
"id": "jvasp-115833",
"created_at": "2022-09-04T14:38:40.259778Z",
"updated_at": "2022-09-04T14:38:40.259798Z",
"structure_string": "Rb3 Ag1 S1\n1.0\n6.279399 0.000000 -0.000000\n0.000000 6.279399 -0.000000\n0.000000 0.000000 6.279399\nRb Ag S\n3 1 1\ndirect\n0.000000 0.500000 0.500000 Rb\n0.500000 0.500000 0.000000 Rb\n0.500000 0.000000 0.500000 Rb\n0.000000 0.000000 0.000000 Ag\n0.500000 0.500000 0.500000 S\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Rb",
"Ag",
"S"
],
"chemical_system": "Ag-Rb-S",
"density": 2.658024859579962,
"density_atomic": 0.020193693761188652,
"volume": 247.6020513696097,
"volume_molar": 29.821888116250808,
"formula_full": "Rb3 Ag1 S1",
"formula_reduced": "Rb3AgS",
"formula_anonymous": "ABC3",
"energy_above_hull": 0.0,
"spacegroup": 221
},
{
"id": "jvasp-118280",
"created_at": "2022-09-04T14:38:32.169255Z",
"updated_at": "2022-09-04T14:38:32.169281Z",
"structure_string": "Mn1 Zn1 F3\n1.0\n2.901079 -2.900225 0.000317\n2.901079 2.900225 0.000317\n0.000228 0.000000 4.102596\nMn Zn F\n1 1 3\ndirect\n0.497894 0.497894 0.500015 Mn\n0.997734 0.997734 0.999222 Zn\n0.498007 0.498007 0.000079 F\n0.997925 0.498070 0.500321 F\n0.498070 0.997925 0.500321 F\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Mn",
"Zn",
"F"
],
"chemical_system": "F-Mn-Zn",
"density": 4.265611812998614,
"density_atomic": 0.07242525147831777,
"volume": 69.03669504684936,
"volume_molar": 8.314973903546434,
"formula_full": "Mn1 Zn1 F3",
"formula_reduced": "MnZnF3",
"formula_anonymous": "ABC3",
"energy_above_hull": 0.1387627641379312,
"spacegroup": 221
},
{
"id": "jvasp-16638",
"created_at": "2022-09-04T14:38:32.152399Z",
"updated_at": "2022-09-04T14:38:32.152416Z",
"structure_string": "Yb3 Sn1 O1\n1.0\n4.713166 -0.000000 -0.000000\n-0.000000 4.713166 -0.000000\n0.000000 -0.000000 4.713166\nYb Sn O\n3 1 1\ndirect\n0.500000 0.000000 0.500000 Yb\n0.500000 0.500000 0.000000 Yb\n0.000000 0.500000 0.500000 Yb\n0.000000 0.000000 0.000000 Sn\n0.500000 0.500000 0.500000 O\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Yb",
"Sn",
"O"
],
"chemical_system": "O-Sn-Yb",
"density": 10.369918288249776,
"density_atomic": 0.04775642363521698,
"volume": 104.69795724638087,
"volume_molar": 12.610116716443352,
"formula_full": "Yb3 Sn1 O1",
"formula_reduced": "Yb3SnO",
"formula_anonymous": "ABC3",
"energy_above_hull": 0.0,
"spacegroup": 221
},
{
"id": "jvasp-114664",
"created_at": "2022-09-04T14:38:43.134614Z",
"updated_at": "2022-09-04T14:38:43.134643Z",
"structure_string": "Rb1 Tl1 Br3\n1.0\n5.769986 0.000000 0.000000\n-0.000000 5.769986 -0.000000\n0.000000 0.000000 5.769986\nRb Tl Br\n1 1 3\ndirect\n0.000000 0.000000 0.000000 Rb\n0.500001 0.500001 0.500001 Tl\n0.000000 0.500001 0.500001 Br\n0.500001 0.000000 0.500001 Br\n0.500001 0.500001 0.000000 Br\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Rb",
"Tl",
"Br"
],
"chemical_system": "Br-Rb-Tl",
"density": 4.577649482755596,
"density_atomic": 0.026028295348205003,
"volume": 192.0986347015928,
"volume_molar": 23.136900359536252,
"formula_full": "Rb1 Tl1 Br3",
"formula_reduced": "RbTlBr3",
"formula_anonymous": "ABC3",
"energy_above_hull": 0.0010160000000003,
"spacegroup": 221
},
{
"id": "jvasp-57129",
"created_at": "2022-09-04T14:38:31.174206Z",
"updated_at": "2022-09-04T14:38:31.174231Z",
"structure_string": "Ta2 Ag2 S6\n1.0\n3.391153 0.000000 0.000000\n-1.695577 7.093320 0.000000\n0.000000 0.000000 7.803974\nTa Ag S\n2 2 6\ndirect\n0.737238 0.474478 0.509769 Ta\n0.262760 0.525522 0.009769 Ta\n0.000062 0.000125 0.759907 Ag\n-0.000062 -0.000125 0.259907 Ag\n0.673015 0.346031 0.189471 S\n0.673028 0.346057 0.830053 S\n0.326970 0.653943 0.330053 S\n0.897031 0.794066 0.009799 S\n0.102967 0.205934 0.509799 S\n0.326983 0.653968 0.689471 S\n",
"nsites": 10,
"nelements": 3,
"elements": [
"Ta",
"Ag",
"S"
],
"chemical_system": "Ag-S-Ta",
"density": 6.8114499574828,
"density_atomic": 0.05327055839254406,
"volume": 187.7209532198115,
"volume_molar": 11.3048200389108,
"formula_full": "Ta2 Ag2 S6",
"formula_reduced": "TaAgS3",
"formula_anonymous": "ABC3",
"energy_above_hull": 2.431443292,
"spacegroup": 63
},
{
"id": "jvasp-35194",
"created_at": "2022-09-04T14:38:32.122559Z",
"updated_at": "2022-09-04T14:38:32.122585Z",
"structure_string": "Zn2 Ge2 O6\n1.0\n-2.544634 -4.407436 -0.000000\n-5.089269 -0.000000 -0.000000\n-2.544634 -1.469145 -4.409020\nZn Ge O\n2 2 6\ndirect\n0.723455 0.723454 0.829634 Zn\n0.223455 0.223455 0.329634 Zn\n0.498731 0.498731 0.503806 Ge\n0.998732 0.998730 0.003806 Ge\n0.272945 0.633346 0.219586 O\n0.874122 0.272944 0.219586 O\n0.633347 0.874121 0.219586 O\n0.133346 0.772945 0.719586 O\n0.374121 0.133346 0.719586 O\n0.772945 0.374120 0.719586 O\n",
"nsites": 10,
"nelements": 3,
"elements": [
"Zn",
"Ge",
"O"
],
"chemical_system": "Ge-O-Zn",
"density": 6.247679480896578,
"density_atomic": 0.10111521503770311,
"volume": 98.89708483803622,
"volume_molar": 5.955721656483159,
"formula_full": "Zn2 Ge2 O6",
"formula_reduced": "ZnGeO3",
"formula_anonymous": "ABC3",
"energy_above_hull": 1.04631537,
"spacegroup": 161
},
{
"id": "jvasp-25988",
"created_at": "2022-09-04T14:38:35.106471Z",
"updated_at": "2022-09-04T14:38:35.106496Z",
"structure_string": "V2 Hg2 O6\n1.0\n3.604885 0.060417 0.002872\n-0.161208 4.836641 0.003324\n-1.744530 -0.506706 8.532965\nV Hg O\n2 2 6\ndirect\n0.676528 0.376681 0.864525 V\n0.323469 0.623318 0.135474 V\n0.139493 0.184176 0.423338 Hg\n0.860505 0.815823 0.576661 Hg\n0.603094 0.478865 0.671991 O\n0.396904 0.521135 0.328007 O\n0.658678 0.038558 0.846732 O\n0.341320 0.961441 0.153267 O\n0.204798 0.477732 0.910209 O\n0.795199 0.522267 0.089790 O\n",
"nsites": 10,
"nelements": 3,
"elements": [
"V",
"Hg",
"O"
],
"chemical_system": "Hg-O-V",
"density": 6.681179682296664,
"density_atomic": 0.06716363102481482,
"volume": 148.8901038763869,
"volume_molar": 8.966371633146235,
"formula_full": "V2 Hg2 O6",
"formula_reduced": "VHgO3",
"formula_anonymous": "ABC3",
"energy_above_hull": 1.75589786,
"spacegroup": 2
},
{
"id": "jvasp-114181",
"created_at": "2022-09-04T14:38:40.811755Z",
"updated_at": "2022-09-04T14:38:40.811777Z",
"structure_string": "Sr1 Ca3 S1\n1.0\n5.665762 0.000000 -0.000000\n-0.000000 5.665762 0.000000\n-0.000000 0.000000 5.665762\nSr Ca S\n1 3 1\ndirect\n0.000000 0.000000 0.000000 Sr\n0.499999 0.000000 0.499999 Ca\n0.000000 0.499999 0.499999 Ca\n0.499999 0.499999 0.000000 Ca\n0.499999 0.499999 0.499999 S\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Sr",
"Ca",
"S"
],
"chemical_system": "Ca-S-Sr",
"density": 2.190477306360285,
"density_atomic": 0.027491283881322305,
"volume": 181.8758273198372,
"volume_molar": 21.905636659230268,
"formula_full": "Sr1 Ca3 S1",
"formula_reduced": "SrCa3S",
"formula_anonymous": "ABC3",
"energy_above_hull": 0.0,
"spacegroup": 221
},
{
"id": "jvasp-56683",
"created_at": "2022-09-04T14:38:35.120498Z",
"updated_at": "2022-09-04T14:38:35.120515Z",
"structure_string": "V4 Cd4 O12\n1.0\n3.608652 0.000000 0.000000\n-0.000000 5.293657 0.000000\n0.000000 0.000000 14.380463\nV Cd O\n4 4 12\ndirect\n0.749999 0.581609 0.418859 V\n0.749999 0.918392 0.918859 V\n0.250000 0.418392 0.581141 V\n0.250000 0.081609 0.081141 V\n0.749999 0.624489 0.178665 Cd\n0.250000 0.124489 0.321335 Cd\n0.250000 0.375511 0.821335 Cd\n0.749999 0.875512 0.678665 Cd\n0.250000 0.106729 0.609395 O\n0.250000 0.610257 0.692183 O\n0.250000 0.034726 0.944406 O\n0.250000 0.393271 0.109395 O\n0.749999 0.110257 0.807817 O\n0.749999 0.893271 0.390605 O\n0.749999 0.965275 0.055594 O\n0.749999 0.534726 0.555594 O\n0.749999 0.389744 0.307817 O\n0.250000 0.889744 0.192183 O\n0.250000 0.465275 0.444406 O\n0.749999 0.606729 0.890605 O\n",
"nsites": 20,
"nelements": 3,
"elements": [
"V",
"Cd",
"O"
],
"chemical_system": "Cd-O-V",
"density": 5.110214258942695,
"density_atomic": 0.07280418184502578,
"volume": 274.7094946080555,
"volume_molar": 8.271696223190856,
"formula_full": "V4 Cd4 O12",
"formula_reduced": "VCdO3",
"formula_anonymous": "ABC3",
"energy_above_hull": 1.66380289,
"spacegroup": 62
},
{
"id": "jvasp-21053",
"created_at": "2022-09-04T14:38:31.326780Z",
"updated_at": "2022-09-04T14:38:31.326804Z",
"structure_string": "Er2 B6 Mo2\n1.0\n0.000000 5.401887 -0.000795\n3.151779 0.000000 0.000000\n0.000000 -1.379142 -6.696889\nEr B Mo\n2 6 2\ndirect\n0.824472 0.750000 0.290843 Er\n0.175529 0.250000 0.709157 Er\n0.581882 0.250000 0.523597 B\n0.418119 0.750000 0.476403 B\n0.587636 0.250000 0.004551 B\n0.412365 0.750000 0.995449 B\n0.916218 0.250000 0.007000 B\n0.083783 0.750000 0.992999 B\n0.689661 0.750000 0.778147 Mo\n0.310339 0.250000 0.221852 Mo\n",
"nsites": 10,
"nelements": 3,
"elements": [
"Er",
"B",
"Mo"
],
"chemical_system": "B-Er-Mo",
"density": 8.610790419135164,
"density_atomic": 0.08770260319723756,
"volume": 114.02170101508432,
"volume_molar": 6.866547332074726,
"formula_full": "Er2 B6 Mo2",
"formula_reduced": "ErB3Mo",
"formula_anonymous": "ABC3",
"energy_above_hull": 4.299856729999999,
"spacegroup": 11
},
{
"id": "jvasp-16267",
"created_at": "2022-09-04T14:38:32.112943Z",
"updated_at": "2022-09-04T14:38:32.112963Z",
"structure_string": "Lu3 Tl1 C1\n1.0\n4.754637 -0.000000 -0.000000\n0.000000 4.754637 0.000000\n-0.000000 0.000000 4.754637\nLu Tl C\n3 1 1\ndirect\n0.500000 0.000000 0.500000 Lu\n0.000000 0.500000 0.500000 Lu\n0.500000 0.500000 0.000000 Lu\n0.000000 0.000000 0.000000 Tl\n0.500000 0.500000 0.500000 C\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Lu",
"Tl",
"C"
],
"chemical_system": "C-Lu-Tl",
"density": 11.452177517643293,
"density_atomic": 0.046517665061540064,
"volume": 107.48604843741194,
"volume_molar": 12.945922268525457,
"formula_full": "Lu3 Tl1 C1",
"formula_reduced": "Lu3TlC",
"formula_anonymous": "ABC3",
"energy_above_hull": 1.8875039700000005,
"spacegroup": 221
}
]
}