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=chemical_system&page=4593",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=chemical_system&page=4591",
"results": [
{
"id": "jvasp-7629",
"created_at": "2022-09-04T14:38:11.293267Z",
"updated_at": "2022-09-04T14:38:11.293293Z",
"structure_string": "Sn1 S1\n1.0\n3.978992 -0.000000 2.297272\n1.326331 3.751430 2.297272\n0.000000 0.000000 4.594544\nSn S\n1 1\ndirect\n0.000000 0.000000 0.000000 Sn\n0.250000 0.250000 0.250000 S\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Sn",
"S"
],
"chemical_system": "S-Sn",
"density": 3.650615610596642,
"density_atomic": 0.029162024308093133,
"volume": 68.58234458864209,
"volume_molar": 20.650626638181347,
"formula_full": "Sn1 S1",
"formula_reduced": "SnS",
"formula_anonymous": "AB",
"energy_above_hull": 0.6627358500000001,
"spacegroup": 216
},
{
"id": "jvasp-34317",
"created_at": "2022-09-04T14:37:08.883092Z",
"updated_at": "2022-09-04T14:37:08.883103Z",
"structure_string": "Sn2 S2\n1.0\n4.137392 0.000363 0.000000\n-0.049667 4.137093 -0.000000\n0.000000 -0.000000 22.554865\nSn S\n2 2\ndirect\n0.752652 0.747346 0.434839 Sn\n0.252653 0.247346 0.565162 Sn\n0.213346 0.286653 0.450854 S\n0.713346 0.786652 0.549147 S\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Sn",
"S"
],
"chemical_system": "S-Sn",
"density": 1.2970173532347344,
"density_atomic": 0.010360896795942917,
"volume": 386.06696686394037,
"volume_molar": 58.12374043102262,
"formula_full": "Sn2 S2",
"formula_reduced": "SnS",
"formula_anonymous": "AB",
"energy_above_hull": 0.5661458500000002,
"spacegroup": 39
},
{
"id": "jvasp-36000",
"created_at": "2022-09-04T14:37:09.001395Z",
"updated_at": "2022-09-04T14:37:09.001408Z",
"structure_string": "Sn2 S4\n1.0\n5.088326 -0.000000 -2.314225\n-1.052534 4.978274 -2.314225\n-0.077701 -0.095847 6.580163\nSn S\n2 4\ndirect\n0.250001 0.749999 0.500000 Sn\n0.000000 0.000000 0.000000 Sn\n0.856299 0.874999 0.250001 S\n0.625001 0.143701 0.750000 S\n0.393703 0.375000 0.250000 S\n0.125001 0.606297 0.750000 S\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Sn",
"S"
],
"chemical_system": "S-Sn",
"density": 3.6930189634623276,
"density_atomic": 0.03649072418782279,
"volume": 164.42534735998038,
"volume_molar": 16.503209771894937,
"formula_full": "Sn2 S4",
"formula_reduced": "SnS2",
"formula_anonymous": "AB2",
"energy_above_hull": 1.1287439,
"spacegroup": 122
},
{
"id": "jvasp-1109",
"created_at": "2022-09-04T14:37:16.659682Z",
"updated_at": "2022-09-04T14:37:16.659714Z",
"structure_string": "Sn4 S4\n1.0\n4.033602 0.000000 0.000000\n0.000000 4.394494 0.000000\n0.000000 0.000000 11.424319\nSn S\n4 4\ndirect\n0.250000 0.372715 0.621014 Sn\n0.750000 0.627284 0.378986 Sn\n0.750000 0.872715 0.878986 Sn\n0.250000 0.127284 0.121014 Sn\n0.250000 0.027870 0.350891 S\n0.750000 0.972129 0.649109 S\n0.750000 0.527870 0.149109 S\n0.250000 0.472130 0.850891 S\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Sn",
"S"
],
"chemical_system": "S-Sn",
"density": 4.9454542097543905,
"density_atomic": 0.039505516675267936,
"volume": 202.5033634102127,
"volume_molar": 15.243796985371683,
"formula_full": "Sn4 S4",
"formula_reduced": "SnS",
"formula_anonymous": "AB",
"energy_above_hull": 0.4932308500000002,
"spacegroup": 62
},
{
"id": "jvasp-290",
"created_at": "2022-09-04T14:38:08.671910Z",
"updated_at": "2022-09-04T14:38:08.671935Z",
"structure_string": "Sn2 S4\n1.0\n1.854335 -3.211802 0.000000\n1.854335 3.211802 0.000000\n0.000000 0.000000 11.852183\nSn S\n2 4\ndirect\n0.666666 0.333332 0.374920 Sn\n0.333332 0.666666 0.874920 Sn\n0.333332 0.666666 0.249970 S\n0.666666 0.333332 0.749970 S\n0.000000 0.000000 0.000108 S\n0.000000 0.000000 0.500108 S\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Sn",
"S"
],
"chemical_system": "S-Sn",
"density": 4.301154093124243,
"density_atomic": 0.04249970803138631,
"volume": 141.17744045603706,
"volume_molar": 14.16984030937956,
"formula_full": "Sn2 S4",
"formula_reduced": "SnS2",
"formula_anonymous": "AB2",
"energy_above_hull": 1.100810566666667,
"spacegroup": 186
},
{
"id": "jvasp-8179",
"created_at": "2022-09-04T14:36:59.723037Z",
"updated_at": "2022-09-04T14:36:59.723058Z",
"structure_string": "Sn2 S2\n1.0\n4.157505 0.031613 0.000000\n-0.024437 4.157553 0.000000\n0.000000 0.000000 5.807446\nSn S\n2 2\ndirect\n0.246518 0.746518 0.754046 Sn\n0.746518 0.246518 0.245954 Sn\n0.729480 0.229481 0.760641 S\n0.229480 0.729481 0.239359 S\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Sn",
"S"
],
"chemical_system": "S-Sn",
"density": 4.9880783431718365,
"density_atomic": 0.03984600884081472,
"volume": 100.38646570551263,
"volume_molar": 15.113535671937743,
"formula_full": "Sn2 S2",
"formula_reduced": "SnS",
"formula_anonymous": "AB",
"energy_above_hull": 0.5017258500000001,
"spacegroup": 39
},
{
"id": "jvasp-13103",
"created_at": "2022-09-04T14:37:02.487062Z",
"updated_at": "2022-09-04T14:37:02.487082Z",
"structure_string": "Sr4 Sn2 S8\n1.0\n6.325211 0.013753 -0.000000\n-2.132349 5.954962 -0.000000\n0.000000 -0.000000 10.037691\nSr Sn S\n4 2 8\ndirect\n0.207022 0.207022 0.500000 Sr\n0.207022 0.207022 0.000000 Sr\n0.859830 0.477250 0.250000 Sr\n0.477251 0.859830 0.750000 Sr\n0.459782 0.902551 0.250000 Sn\n0.902551 0.459782 0.750000 Sn\n0.648817 0.100203 0.446550 S\n0.100203 0.648817 0.553450 S\n0.648817 0.100203 0.053450 S\n0.100203 0.648817 0.946550 S\n0.383825 0.501996 0.250000 S\n0.501996 0.383825 0.750000 S\n0.952757 0.091181 0.750000 S\n0.091181 0.952757 0.250000 S\n",
"nsites": 14,
"nelements": 3,
"elements": [
"Sr",
"Sn",
"S"
],
"chemical_system": "S-Sn-Sr",
"density": 3.705798267359647,
"density_atomic": 0.037000040646458614,
"volume": 378.3779627101567,
"volume_molar": 16.276038228018535,
"formula_full": "Sr4 Sn2 S8",
"formula_reduced": "Sr2SnS4",
"formula_anonymous": "AB2C4",
"energy_above_hull": 0.8998520457142858,
"spacegroup": 40
},
{
"id": "jvasp-112321",
"created_at": "2022-09-04T14:38:26.538753Z",
"updated_at": "2022-09-04T14:38:26.538780Z",
"structure_string": "Sr6 Sn4 S14\n1.0\n4.009073 -0.000000 0.000000\n0.000000 11.522635 0.000000\n-0.000000 -0.000000 12.808981\nSr Sn S\n6 4 14\ndirect\n0.500000 0.115269 0.150647 Sr\n0.500000 0.884730 0.849353 Sr\n0.500000 0.384731 0.650647 Sr\n0.500000 0.615269 0.349353 Sr\n0.500000 0.000000 0.500000 Sr\n0.500000 0.500000 -0.000000 Sr\n-0.000000 0.282694 0.394115 Sn\n-0.000000 0.717306 0.605885 Sn\n-0.000000 0.217306 0.894115 Sn\n-0.000000 0.782694 0.105885 Sn\n-0.000000 0.797484 0.430455 S\n-0.000000 0.202515 0.569545 S\n-0.000000 0.702515 0.930455 S\n-0.000000 0.297484 0.069545 S\n-0.000000 0.580739 0.176708 S\n-0.000000 0.419260 0.823292 S\n0.500000 0.647338 0.706551 S\n-0.000000 0.080740 0.323292 S\n0.500000 0.852662 0.206551 S\n0.500000 0.147338 0.793449 S\n0.000000 0.000000 0.000000 S\n0.500000 0.352662 0.293449 S\n-0.000000 0.919260 0.676708 S\n-0.000000 0.500000 0.500000 S\n",
"nsites": 24,
"nelements": 3,
"elements": [
"Sr",
"Sn",
"S"
],
"chemical_system": "S-Sn-Sr",
"density": 4.067691217754433,
"density_atomic": 0.04056027500810372,
"volume": 591.7119643593376,
"volume_molar": 14.847386411450142,
"formula_full": "Sr6 Sn4 S14",
"formula_reduced": "Sr3Sn2S7",
"formula_anonymous": "A2B3C7",
"energy_above_hull": 1.141822694166667,
"spacegroup": 55
},
{
"id": "jvasp-15405",
"created_at": "2022-09-04T14:36:40.085044Z",
"updated_at": "2022-09-04T14:36:40.085066Z",
"structure_string": "Ta2 Sn2 S4\n1.0\n1.671565 -2.895235 0.000000\n1.671565 2.895235 -0.000000\n0.000000 -0.000000 17.678477\nTa Sn S\n2 2 4\ndirect\n0.666666 0.333331 0.250000 Ta\n0.333331 0.666666 0.750000 Ta\n0.000000 0.000000 0.000000 Sn\n0.000000 0.000000 0.500000 Sn\n0.000000 0.000000 0.661594 S\n0.000000 0.000000 0.161594 S\n0.000000 0.000000 0.838407 S\n0.000000 0.000000 0.338407 S\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Ta",
"Sn",
"S"
],
"chemical_system": "S-Sn-Ta",
"density": 7.0606614195487785,
"density_atomic": 0.04675284612771407,
"volume": 171.11257736366503,
"volume_molar": 12.880800333629756,
"formula_full": "Ta2 Sn2 S4",
"formula_reduced": "TaSnS2",
"formula_anonymous": "ABC2",
"energy_above_hull": 2.4916052250000003,
"spacegroup": 194
},
{
"id": "jvasp-22384",
"created_at": "2022-09-04T14:38:35.067452Z",
"updated_at": "2022-09-04T14:38:35.067468Z",
"structure_string": "Ta6 Sn2 S12\n1.0\n2.903193 -5.028479 0.000000\n2.903193 5.028479 -0.000000\n0.000000 -0.000000 14.645955\nTa Sn S\n6 2 12\ndirect\n0.333332 0.666667 0.250000 Ta\n0.666667 0.333332 0.750000 Ta\n0.666667 0.333332 0.250000 Ta\n0.333332 0.666667 0.750000 Ta\n0.000000 0.000000 0.250000 Ta\n0.000000 0.000000 0.750000 Ta\n0.000000 0.000000 0.500000 Sn\n0.000000 0.000000 0.000000 Sn\n-0.000000 0.336578 0.357017 S\n0.336578 0.336578 0.857016 S\n-0.000000 0.663421 0.857016 S\n-0.000000 0.663421 0.642983 S\n0.663421 -0.000000 0.642983 S\n-0.000000 0.336578 0.142983 S\n0.336578 0.336578 0.642983 S\n0.663421 0.663421 0.142983 S\n0.336578 -0.000000 0.357017 S\n0.336578 -0.000000 0.142983 S\n0.663421 0.663421 0.357017 S\n0.663421 -0.000000 0.857016 S\n",
"nsites": 20,
"nelements": 3,
"elements": [
"Ta",
"Sn",
"S"
],
"chemical_system": "S-Sn-Ta",
"density": 6.632054120174787,
"density_atomic": 0.04677025693807221,
"volume": 427.6221964416765,
"volume_molar": 12.876005295360736,
"formula_full": "Ta6 Sn2 S12",
"formula_reduced": "Ta3SnS6",
"formula_anonymous": "AB3C6",
"energy_above_hull": 3.71628693,
"spacegroup": 193
},
{
"id": "jvasp-34443",
"created_at": "2022-09-04T14:38:14.433463Z",
"updated_at": "2022-09-04T14:38:14.433487Z",
"structure_string": "Tb4 Sn2 S10\n1.0\n3.822849 0.000000 0.000000\n0.000000 7.735219 0.000000\n0.000000 -0.000000 11.404849\nTb Sn S\n4 2 10\ndirect\n0.500000 0.971587 0.327239 Tb\n0.500000 0.471587 0.172761 Tb\n0.500000 0.528413 0.827239 Tb\n0.500000 0.028413 0.672761 Tb\n0.000000 0.500000 0.500000 Sn\n0.000000 0.000000 0.000000 Sn\n0.500000 0.670513 0.598142 S\n0.000000 0.178309 0.195506 S\n0.500000 0.170513 0.901858 S\n0.000000 0.000000 0.500000 S\n0.500000 0.829487 0.098142 S\n0.000000 0.678310 0.304494 S\n0.000000 0.321691 0.695506 S\n0.000000 0.821691 0.804494 S\n0.500000 0.329487 0.401858 S\n0.000000 0.500000 0.000000 S\n",
"nsites": 16,
"nelements": 3,
"elements": [
"Tb",
"Sn",
"S"
],
"chemical_system": "S-Sn-Tb",
"density": 5.877883442883868,
"density_atomic": 0.047442840699521094,
"volume": 337.247933810201,
"volume_molar": 12.693465802651211,
"formula_full": "Tb4 Sn2 S10",
"formula_reduced": "Tb2SnS5",
"formula_anonymous": "AB2C5",
"energy_above_hull": 1.6587973125,
"spacegroup": 55
},
{
"id": "jvasp-14125",
"created_at": "2022-09-04T14:38:06.324547Z",
"updated_at": "2022-09-04T14:38:06.324566Z",
"structure_string": "Tl4 Sn4 S6\n1.0\n6.926577 -0.076438 -1.786424\n-0.937059 6.991191 -3.932442\n-0.052392 -0.024884 8.260666\nTl Sn S\n4 4 6\ndirect\n0.507117 0.225874 0.239423 Tl\n0.992884 0.986451 0.760578 Tl\n0.492884 0.774126 0.760578 Tl\n0.007116 0.013549 0.239423 Tl\n0.467593 0.748593 0.240268 Sn\n0.032407 0.508327 0.759734 Sn\n0.532408 0.251407 0.759734 Sn\n0.967593 0.491674 0.240268 Sn\n0.695100 0.637628 0.453249 S\n0.804901 0.184381 0.546752 S\n0.304900 0.362372 0.546752 S\n0.195100 0.815619 0.453249 S\n0.750000 0.589695 0.000000 S\n0.250000 0.410305 0.000000 S\n",
"nsites": 14,
"nelements": 3,
"elements": [
"Tl",
"Sn",
"S"
],
"chemical_system": "S-Sn-Tl",
"density": 6.194092755874457,
"density_atomic": 0.03517219301836694,
"volume": 398.041714165767,
"volume_molar": 17.121880221842392,
"formula_full": "Tl4 Sn4 S6",
"formula_reduced": "Tl2Sn2S3",
"formula_anonymous": "A2B2C3",
"energy_above_hull": 0.7836355142857144,
"spacegroup": 15
}
]
}