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=-volume_molar&page=1102",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-volume_molar&page=1100",
"results": [
{
"id": "jvasp-40085",
"created_at": "2022-09-04T14:37:40.906018Z",
"updated_at": "2022-09-04T14:37:40.906047Z",
"structure_string": "Lu2 Cd1 In1\n1.0\n0.000000 3.654779 3.654779\n3.654779 -0.000000 3.654779\n3.654779 3.654779 0.000000\nLu Cd In\n2 1 1\ndirect\n0.000000 0.000000 0.000000 Lu\n0.499999 0.499999 0.499999 Lu\n0.250000 0.250000 0.250000 Cd\n0.750000 0.750000 0.750000 In\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Lu",
"Cd",
"In"
],
"chemical_system": "Cd-In-Lu",
"density": 9.815992580168146,
"density_atomic": 0.04096817643356657,
"volume": 97.63675975391155,
"volume_molar": 14.699557764708958,
"formula_full": "Lu2 Cd1 In1",
"formula_reduced": "Lu2CdIn",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-41080",
"created_at": "2022-09-04T14:38:19.870985Z",
"updated_at": "2022-09-04T14:38:19.870995Z",
"structure_string": "Li1 Yb2 Ga1\n1.0\n-0.000000 3.654778 3.654778\n3.654778 -0.000000 3.654778\n3.654778 3.654778 0.000000\nYb Li Ga\n2 1 1\ndirect\n0.000000 0.000000 0.000000 Yb\n0.500001 0.500001 0.500001 Yb\n0.749999 0.749999 0.749999 Li\n0.250000 0.250000 0.250000 Ga\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Yb",
"Li",
"Ga"
],
"chemical_system": "Ga-Li-Yb",
"density": 7.1897460050722435,
"density_atomic": 0.04096821006202853,
"volume": 97.63667960947622,
"volume_molar": 14.69954569868219,
"formula_full": "Li1 Yb2 Ga1",
"formula_reduced": "LiYb2Ga",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-40189",
"created_at": "2022-09-04T14:38:01.249438Z",
"updated_at": "2022-09-04T14:38:01.249467Z",
"structure_string": "Ca4 Sn2 S8\n1.0\n0.000000 5.022217 -3.497761\n0.000000 -5.022217 -3.497761\n-9.726222 0.000000 0.000000\nCa Sn S\n4 2 8\ndirect\n0.140387 0.524809 0.250000 Ca\n0.524809 0.140387 0.750000 Ca\n0.796083 0.796083 0.500000 Ca\n0.796083 0.796083 0.000000 Ca\n0.541534 0.097955 0.250000 Sn\n0.097955 0.541534 0.750000 Sn\n0.925167 0.051911 0.250000 S\n0.051911 0.925167 0.750000 S\n0.618052 0.510241 0.250000 S\n0.510241 0.618052 0.750000 S\n0.347874 0.880383 0.448958 S\n0.880383 0.347874 0.551041 S\n0.347874 0.880383 0.051041 S\n0.880383 0.347874 0.948958 S\n",
"nsites": 14,
"nelements": 3,
"elements": [
"Ca",
"Sn",
"S"
],
"chemical_system": "Ca-S-Sn",
"density": 3.1793209937919937,
"density_atomic": 0.04097021632862727,
"volume": 341.7116445689287,
"volume_molar": 14.698825878036986,
"formula_full": "Ca4 Sn2 S8",
"formula_reduced": "Ca2SnS4",
"formula_anonymous": "AB2C4",
"energy_above_hull": 0.95136322,
"spacegroup": 40
},
{
"id": "jvasp-12172",
"created_at": "2022-09-04T14:36:01.276277Z",
"updated_at": "2022-09-04T14:36:01.276313Z",
"structure_string": "Cr1 P2 S7\n1.0\n4.283543 4.665783 0.033660\n-4.283543 4.665783 -0.033660\n-0.831536 0.000000 6.099696\nCr P S\n1 2 7\ndirect\n0.491862 0.491862 0.000000 Cr\n0.044043 0.655267 0.079681 P\n0.655267 0.044043 0.920320 P\n0.140580 0.506147 0.818895 S\n0.531169 0.807102 0.764251 S\n0.317826 0.633412 0.284859 S\n0.992087 0.992087 0.000000 S\n0.633411 0.317826 0.715142 S\n0.807102 0.531169 0.235749 S\n0.506147 0.140581 0.181105 S\n",
"nsites": 10,
"nelements": 3,
"elements": [
"Cr",
"P",
"S"
],
"chemical_system": "Cr-P-S",
"density": 2.302220148946212,
"density_atomic": 0.04097030194263868,
"volume": 244.07923607691998,
"volume_molar": 14.698795162484823,
"formula_full": "Cr1 P2 S7",
"formula_reduced": "CrP2S7",
"formula_anonymous": "AB2C7",
"energy_above_hull": 2.8461768400000005,
"spacegroup": 5
},
{
"id": "jvasp-117188",
"created_at": "2022-09-04T14:38:46.596059Z",
"updated_at": "2022-09-04T14:38:46.596085Z",
"structure_string": "Dy12 In2 Co4\n1.0\n7.823940 0.033043 -2.775210\n-3.673189 6.758003 -3.123142\n0.029103 -0.033043 8.301505\nDy In Co\n12 2 4\ndirect\n0.442330 0.236133 0.206198 Dy\n0.676517 0.988190 0.311673 Dy\n0.323482 0.011809 0.688327 Dy\n0.676517 0.364844 0.688327 Dy\n0.815107 0.285664 0.100772 Dy\n0.184892 0.714336 0.899229 Dy\n0.323482 0.635155 0.311673 Dy\n0.184893 0.285664 0.470558 Dy\n0.970065 0.763867 0.206198 Dy\n0.029934 0.236133 0.793802 Dy\n0.557669 0.763867 0.793802 Dy\n0.815107 0.714335 0.529443 Dy\n0.500000 0.500000 -0.000000 In\n0.000000 0.000000 0.000000 In\n0.113850 0.613851 0.500000 Co\n0.341106 0.000000 0.341107 Co\n0.658893 0.000000 0.658894 Co\n0.886149 0.386149 0.500000 Co\n",
"nsites": 18,
"nelements": 3,
"elements": [
"Dy",
"In",
"Co"
],
"chemical_system": "Co-Dy-In",
"density": 9.12914598070815,
"density_atomic": 0.04097039121294799,
"volume": 439.3416676556266,
"volume_molar": 14.69876313530735,
"formula_full": "Dy12 In2 Co4",
"formula_reduced": "Dy6InCo2",
"formula_anonymous": "AB2C6",
"energy_above_hull": 1.8759600855555552,
"spacegroup": 71
},
{
"id": "jvasp-123446",
"created_at": "2022-09-04T14:38:54.479178Z",
"updated_at": "2022-09-04T14:38:54.479195Z",
"structure_string": "Zr1 Te1\n1.0\n1.901217 -3.293001 -0.000000\n1.901217 3.293001 -0.000000\n-0.000000 0.000000 3.898562\nZr Te\n1 1\ndirect\n0.333334 0.666667 0.750000 Zr\n0.666667 0.333334 0.250000 Te\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Zr",
"Te"
],
"chemical_system": "Te-Zr",
"density": 7.443651936174435,
"density_atomic": 0.040970569721401805,
"volume": 48.815528160821735,
"volume_molar": 14.698699092910621,
"formula_full": "Zr1 Te1",
"formula_reduced": "ZrTe",
"formula_anonymous": "AB",
"energy_above_hull": 1.2789511333333334,
"spacegroup": 187
},
{
"id": "jvasp-92568",
"created_at": "2022-09-04T14:35:41.696597Z",
"updated_at": "2022-09-04T14:35:41.696625Z",
"structure_string": "K1 Fe2 Te2\n1.0\n3.875471 -0.000000 -0.000000\n-0.000000 3.875471 -0.000000\n-1.937735 -1.937735 8.125409\nK Fe Te\n1 2 2\ndirect\n0.000000 0.000000 0.000000 K\n0.250001 0.750000 0.500000 Fe\n0.750000 0.250001 0.500000 Fe\n0.638956 0.638956 0.277912 Te\n0.361045 0.361045 0.722088 Te\n",
"nsites": 5,
"nelements": 3,
"elements": [
"K",
"Fe",
"Te"
],
"chemical_system": "Fe-K-Te",
"density": 5.524187385272946,
"density_atomic": 0.04097092703192007,
"volume": 122.0377560923761,
"volume_molar": 14.698570904456728,
"formula_full": "K1 Fe2 Te2",
"formula_reduced": "K(FeTe)2",
"formula_anonymous": "AB2C2",
"energy_above_hull": 1.5962849066666664,
"spacegroup": 139
},
{
"id": "jvasp-103604",
"created_at": "2022-09-04T14:36:54.630565Z",
"updated_at": "2022-09-04T14:36:54.630589Z",
"structure_string": "Ho2 Tl1 Zn1\n1.0\n4.476037 -0.000000 2.584241\n1.492012 4.220048 2.584241\n-0.000000 -0.000000 5.168482\nHo Tl Zn\n2 1 1\ndirect\n0.750000 0.750000 0.749999 Ho\n0.250000 0.250000 0.250000 Ho\n0.500000 0.500000 0.499999 Tl\n0.000000 0.000000 0.000000 Zn\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ho",
"Tl",
"Zn"
],
"chemical_system": "Ho-Tl-Zn",
"density": 10.199408777222276,
"density_atomic": 0.040971883067187666,
"volume": 97.62792677701944,
"volume_molar": 14.698227928954605,
"formula_full": "Ho2 Tl1 Zn1",
"formula_reduced": "Ho2TlZn",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.0559360333333332,
"spacegroup": 225
},
{
"id": "jvasp-38226",
"created_at": "2022-09-04T14:36:07.715022Z",
"updated_at": "2022-09-04T14:36:07.715047Z",
"structure_string": "Mn2 Sn6\n1.0\n3.199216 -5.541206 -0.000000\n3.199216 5.541206 -0.000000\n-0.000000 0.000000 5.506910\nMn Sn\n2 6\ndirect\n0.333333 0.666668 0.750000 Mn\n0.666668 0.333333 0.250000 Mn\n0.657855 0.828929 0.250000 Sn\n0.171073 0.828929 0.250000 Sn\n0.171072 0.342146 0.250000 Sn\n0.342146 0.171072 0.750000 Sn\n0.828929 0.171073 0.750000 Sn\n0.828929 0.657855 0.750000 Sn\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Mn",
"Sn"
],
"chemical_system": "Mn-Sn",
"density": 6.992089476640183,
"density_atomic": 0.04097360284903033,
"volume": 195.24765809529796,
"volume_molar": 14.697611001377972,
"formula_full": "Mn2 Sn6",
"formula_reduced": "MnSn3",
"formula_anonymous": "AB3",
"energy_above_hull": 1.4546305853448276,
"spacegroup": 194
},
{
"id": "jvasp-30570",
"created_at": "2022-09-04T14:36:33.651699Z",
"updated_at": "2022-09-04T14:36:33.651739Z",
"structure_string": "V4 S10\n1.0\n4.168906 0.088619 -0.000042\n0.112922 5.909132 0.000563\n0.000100 -0.000751 13.875304\nV S\n4 10\ndirect\n0.038418 0.075032 0.145285 V\n0.416575 0.912706 0.345489 V\n0.498757 0.924982 0.645282 V\n0.120575 0.087288 0.845491 V\n0.536779 0.908773 0.179699 S\n-0.060896 0.082554 0.327417 S\n0.000384 0.091211 0.679697 S\n0.598026 0.917448 0.827417 S\n0.162500 0.420626 0.874416 S\n0.486493 0.584961 0.628841 S\n0.374590 0.579369 0.374425 S\n0.506519 0.057771 0.498850 S\n0.030609 0.942231 -0.001145 S\n0.050662 0.415048 0.128833 S\n",
"nsites": 14,
"nelements": 2,
"elements": [
"V",
"S"
],
"chemical_system": "S-V",
"density": 2.548667504274726,
"density_atomic": 0.04097473809547793,
"volume": 341.6739349834935,
"volume_molar": 14.697203789240614,
"formula_full": "V4 S10",
"formula_reduced": "V2S5",
"formula_anonymous": "A2B5",
"energy_above_hull": 2.879424057142857,
"spacegroup": 4
},
{
"id": "jvasp-39342",
"created_at": "2022-09-04T14:37:56.981082Z",
"updated_at": "2022-09-04T14:37:56.981092Z",
"structure_string": "Li1 Ho1 Sn2\n1.0\n0.000000 3.654568 3.654568\n3.654568 0.000000 3.654568\n3.654568 3.654568 -0.000000\nLi Ho Sn\n1 1 2\ndirect\n0.750000 0.750000 0.750000 Li\n0.250000 0.250000 0.250000 Ho\n0.000000 0.000000 0.000000 Sn\n0.500000 0.500000 0.500000 Sn\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Li",
"Ho",
"Sn"
],
"chemical_system": "Ho-Li-Sn",
"density": 6.962151906008984,
"density_atomic": 0.0409752728545306,
"volume": 97.61985024970306,
"volume_molar": 14.697011979345826,
"formula_full": "Li1 Ho1 Sn2",
"formula_reduced": "LiHoSn2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.6234572416666667,
"spacegroup": 225
},
{
"id": "jvasp-111757",
"created_at": "2022-09-04T14:38:41.221916Z",
"updated_at": "2022-09-04T14:38:41.221942Z",
"structure_string": "Yb4 Sc4 Sb4 O1\n1.0\n4.448349 0.000000 0.000000\n0.000000 4.448349 -0.000000\n0.000000 0.000000 16.033059\nYb Sc Sb O\n4 4 4 1\ndirect\n0.500000 0.500000 0.330625 Yb\n0.000000 0.000000 0.835067 Yb\n0.000000 0.000000 0.164933 Yb\n0.500000 0.500000 0.669375 Yb\n0.500000 0.000000 0.000000 Sc\n0.000000 0.500000 0.500000 Sc\n0.000000 0.500000 0.000000 Sc\n0.500000 0.000000 0.500000 Sc\n0.500000 0.500000 0.131760 Sb\n0.000000 0.000000 0.632468 Sb\n0.000000 0.000000 0.367532 Sb\n0.500000 0.500000 0.868240 Sb\n0.000000 0.000000 0.000000 O\n",
"nsites": 13,
"nelements": 4,
"elements": [
"Yb",
"Sc",
"Sb",
"O"
],
"chemical_system": "O-Sb-Sc-Yb",
"density": 7.196891886564563,
"density_atomic": 0.04097597118058111,
"volume": 317.25910638478825,
"volume_molar": 14.696761508007766,
"formula_full": "Yb4 Sc4 Sb4 O1",
"formula_reduced": "Yb4Sc4Sb4O",
"formula_anonymous": "AB4C4D4",
"energy_above_hull": 1.4246001307692309,
"spacegroup": 123
}
]
}