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=-updated_at&page=3999",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-updated_at&page=3997",
"results": [
{
"id": "jvasp-99471",
"created_at": "2022-09-04T14:36:02.216695Z",
"updated_at": "2022-09-04T14:36:02.216717Z",
"structure_string": "Li2 Tl1 Sb1\n1.0\n4.313172 -0.000000 2.490211\n1.437724 4.066497 2.490211\n-0.000000 -0.000000 4.980422\nLi Tl Sb\n2 1 1\ndirect\n0.250000 0.250000 0.250000 Li\n0.749999 0.750000 0.750000 Li\n0.000000 0.000000 0.000000 Tl\n0.499999 0.500000 0.500000 Sb\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Li",
"Tl",
"Sb"
],
"chemical_system": "Li-Sb-Tl",
"density": 6.463636929638891,
"density_atomic": 0.04579062960935112,
"volume": 87.35411664187167,
"volume_molar": 13.15146965957024,
"formula_full": "Li2 Tl1 Sb1",
"formula_reduced": "Li2TlSb",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.475954675,
"spacegroup": 225
},
{
"id": "jvasp-98343",
"created_at": "2022-09-04T14:36:02.215495Z",
"updated_at": "2022-09-04T14:36:02.215510Z",
"structure_string": "Fe6 P4 H16 O24\n1.0\n10.382884 0.000000 -2.064133\n0.000000 4.702256 0.000000\n-0.121115 0.000000 9.121466\nFe P H O\n6 4 16 24\ndirect\n0.500000 0.500000 0.000000 Fe\n0.000000 0.000000 0.000000 Fe\n0.668930 0.429007 0.326612 Fe\n0.831070 0.929008 0.673389 Fe\n0.331070 0.570994 0.673389 Fe\n0.168930 0.070993 0.326612 Fe\n0.449974 0.971269 0.238641 P\n0.050026 0.471268 0.761360 P\n0.949974 0.528733 0.238641 P\n0.550026 0.028732 0.761360 P\n0.674995 0.435173 0.614953 H\n0.407555 0.292332 0.445011 H\n0.592445 0.707669 0.554990 H\n0.907554 0.207668 0.445011 H\n0.325005 0.564828 0.385048 H\n0.174995 0.064827 0.614953 H\n0.825005 0.935174 0.385048 H\n0.092446 0.792333 0.554990 H\n0.238845 0.720857 0.911483 H\n0.738844 0.779145 0.911483 H\n0.761155 0.279144 0.088518 H\n0.142896 0.443385 0.057112 H\n0.357104 0.943385 0.942889 H\n0.857104 0.556616 0.942889 H\n0.642896 0.056616 0.057112 H\n0.261156 0.220856 0.088518 H\n0.968331 0.654906 0.635931 O\n0.468331 0.845095 0.635931 O\n0.031669 0.345095 0.364069 O\n0.668783 0.247788 0.101284 O\n0.168783 0.252212 0.101284 O\n0.331217 0.752213 0.898717 O\n0.531669 0.154905 0.364070 O\n0.825272 0.107815 0.451618 O\n0.674727 0.607815 0.548383 O\n0.831217 0.747789 0.898717 O\n0.327054 0.856908 0.286700 O\n0.405564 0.158857 0.094422 O\n0.672946 0.143092 0.713301 O\n0.827054 0.643093 0.286700 O\n0.094436 0.658858 0.905578 O\n0.594436 0.841144 0.905579 O\n0.905564 0.341143 0.094422 O\n0.032234 0.782103 0.201082 O\n0.467766 0.282102 0.798919 O\n0.967766 0.217898 0.798919 O\n0.532234 0.717899 0.201082 O\n0.174728 0.892186 0.548382 O\n0.172946 0.356908 0.713301 O\n0.325273 0.392186 0.451618 O\n",
"nsites": 50,
"nelements": 4,
"elements": [
"Fe",
"P",
"H",
"O"
],
"chemical_system": "Fe-H-O-P",
"density": 3.2117411852013444,
"density_atomic": 0.11257164386194461,
"volume": 444.16158709842506,
"volume_molar": 5.349607195383431,
"formula_full": "Fe6 P4 H16 O24",
"formula_reduced": "Fe3P2(H2O3)4",
"formula_anonymous": "A2B3C8D12",
"energy_above_hull": 3.30452278,
"spacegroup": 14
},
{
"id": "jvasp-66615",
"created_at": "2022-09-04T14:36:02.205588Z",
"updated_at": "2022-09-04T14:36:02.205626Z",
"structure_string": "Ba4 Fe1 Pt1\n1.0\n0.000000 4.723279 4.723279\n4.723279 -0.000000 4.723279\n4.723279 4.723279 0.000000\nBa Fe Pt\n4 1 1\ndirect\n0.123927 0.625358 0.625358 Ba\n0.625358 0.625358 0.625358 Ba\n0.625358 0.123927 0.625358 Ba\n0.625358 0.625358 0.123927 Ba\n0.250000 0.250000 0.250000 Fe\n0.000000 0.000000 0.000000 Pt\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Ba",
"Fe",
"Pt"
],
"chemical_system": "Ba-Fe-Pt",
"density": 6.3053170675562775,
"density_atomic": 0.02847019590224631,
"volume": 210.74670580424765,
"volume_molar": 21.152438784324804,
"formula_full": "Ba4 Fe1 Pt1",
"formula_reduced": "Ba4FePt",
"formula_anonymous": "ABC4",
"energy_above_hull": 1.1221717966666669,
"spacegroup": 216
},
{
"id": "jvasp-61272",
"created_at": "2022-09-04T14:36:02.204462Z",
"updated_at": "2022-09-04T14:36:02.204487Z",
"structure_string": "Te4 Au4 I4\n1.0\n0.000000 7.411260 -0.195766\n7.735952 0.000000 0.000000\n0.000000 -2.140331 -6.923136\nTe Au I\n4 4 4\ndirect\n-0.014410 0.862192 0.681301 Te\n0.514411 0.362192 0.318699 Te\n0.014411 0.137807 0.318699 Te\n0.485590 0.637807 0.681302 Te\n0.230297 0.863829 0.468441 Au\n0.269704 0.363829 0.531560 Au\n0.769704 0.136171 0.531560 Au\n0.730297 0.636171 0.468441 Au\n0.389403 0.910760 0.174367 I\n0.110598 0.410760 0.825634 I\n0.610598 0.089240 0.825634 I\n0.889403 0.589240 0.174367 I\n",
"nsites": 12,
"nelements": 3,
"elements": [
"Te",
"Au",
"I"
],
"chemical_system": "Au-I-Te",
"density": 7.49373181705995,
"density_atomic": 0.029987510119527935,
"volume": 400.1666011005553,
"volume_molar": 20.082163327319293,
"formula_full": "Te4 Au4 I4",
"formula_reduced": "TeAuI",
"formula_anonymous": "ABC",
"energy_above_hull": 0.2684638705555556,
"spacegroup": 14
},
{
"id": "jvasp-63976",
"created_at": "2022-09-04T14:36:02.200979Z",
"updated_at": "2022-09-04T14:36:02.201008Z",
"structure_string": "Ba4 Be1 P1\n1.0\n0.000000 4.872151 4.872151\n4.872151 0.000000 4.872151\n4.872151 4.872151 0.000000\nBa Be P\n4 1 1\ndirect\n0.121251 0.626250 0.626250 Ba\n0.626250 0.626250 0.626250 Ba\n0.626250 0.121251 0.626250 Ba\n0.626250 0.626250 0.121251 Ba\n0.250000 0.250000 0.250000 Be\n0.000000 0.000000 0.000000 P\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Ba",
"Be",
"P"
],
"chemical_system": "Ba-Be-P",
"density": 4.230472348441148,
"density_atomic": 0.025939346804898938,
"volume": 231.30883152642966,
"volume_molar": 23.216239041388086,
"formula_full": "Ba4 Be1 P1",
"formula_reduced": "Ba4BeP",
"formula_anonymous": "ABC4",
"energy_above_hull": 0.8303175799999999,
"spacegroup": 216
},
{
"id": "jvasp-74190",
"created_at": "2022-09-04T14:36:02.197223Z",
"updated_at": "2022-09-04T14:36:02.197247Z",
"structure_string": "Mg2 Ti1 Be1\n1.0\n-2.267641 2.267641 3.207437\n2.267641 -2.267641 3.207437\n2.267641 2.267641 -3.207437\nMg Ti Be\n2 1 1\ndirect\n0.000000 0.000000 0.000000 Mg\n0.250000 0.750000 0.500000 Mg\n0.500001 0.500001 0.000000 Ti\n0.750000 0.250000 0.500000 Be\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Mg",
"Ti",
"Be"
],
"chemical_system": "Be-Mg-Ti",
"density": 2.6551575419905267,
"density_atomic": 0.06063079515914067,
"volume": 65.97307506030559,
"volume_molar": 9.932478609580144,
"formula_full": "Mg2 Ti1 Be1",
"formula_reduced": "Mg2TiBe",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.0599131333333334,
"spacegroup": 216
},
{
"id": "jvasp-66343",
"created_at": "2022-09-04T14:36:02.195417Z",
"updated_at": "2022-09-04T14:36:02.195445Z",
"structure_string": "Ba4 Sc1 Mo1\n1.0\n0.000000 4.838218 4.838218\n4.838218 0.000000 4.838218\n4.838218 4.838218 -0.000000\nBa Sc Mo\n4 1 1\ndirect\n0.127360 0.624214 0.624214 Ba\n0.624214 0.624214 0.624214 Ba\n0.624214 0.127360 0.624214 Ba\n0.624214 0.624214 0.127360 Ba\n0.000000 0.000000 0.000000 Sc\n0.250000 0.250000 0.250000 Mo\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Ba",
"Sc",
"Mo"
],
"chemical_system": "Ba-Mo-Sc",
"density": 5.059880028489993,
"density_atomic": 0.026488962963869538,
"volume": 226.50943369069944,
"volume_molar": 22.734528219221303,
"formula_full": "Ba4 Sc1 Mo1",
"formula_reduced": "Ba4ScMo",
"formula_anonymous": "ABC4",
"energy_above_hull": 1.6241275049999997,
"spacegroup": 216
},
{
"id": "jvasp-96851",
"created_at": "2022-09-04T14:36:02.193611Z",
"updated_at": "2022-09-04T14:36:02.193640Z",
"structure_string": "Rb4 P4 Pb4 S16\n1.0\n6.512040 0.000000 0.000000\n0.000000 6.749466 0.000000\n0.000000 0.000000 17.177215\nRb P Pb S\n4 4 4 16\ndirect\n0.006652 0.004970 0.042111 Rb\n0.506652 0.495030 0.957889 Rb\n0.993348 0.504970 0.457889 Rb\n0.493348 0.995031 0.542111 Rb\n0.221038 0.011281 0.347475 P\n0.278962 0.988720 0.847476 P\n0.721038 0.488719 0.652525 P\n0.778962 0.511281 0.152525 P\n0.213678 0.524132 0.728972 Pb\n0.713678 0.975869 0.271028 Pb\n0.786322 0.024132 0.771029 Pb\n0.286322 0.475868 0.228972 Pb\n0.461800 0.492624 0.584854 S\n0.389907 0.758228 0.367277 S\n0.849740 0.533074 0.270313 S\n0.594716 0.749267 0.126118 S\n0.094716 0.750734 0.873882 S\n0.650260 0.466927 0.770313 S\n0.110093 0.241773 0.867277 S\n0.150260 0.033073 0.229687 S\n0.961800 0.007376 0.415146 S\n0.889907 0.741773 0.632723 S\n0.905284 0.250734 0.626119 S\n0.405284 0.249266 0.373882 S\n0.538199 0.992625 0.915146 S\n0.349740 0.966927 0.729687 S\n0.038200 0.507376 0.084854 S\n0.610093 0.258228 0.132723 S\n",
"nsites": 28,
"nelements": 4,
"elements": [
"Rb",
"P",
"Pb",
"S"
],
"chemical_system": "P-Pb-Rb-S",
"density": 3.9757009193375814,
"density_atomic": 0.03708675252361791,
"volume": 754.986567836286,
"volume_molar": 16.237983512212153,
"formula_full": "Rb4 P4 Pb4 S16",
"formula_reduced": "RbPPbS4",
"formula_anonymous": "ABCD4",
"energy_above_hull": 1.4994966171428572,
"spacegroup": 19
},
{
"id": "jvasp-28765",
"created_at": "2022-09-04T14:36:02.190913Z",
"updated_at": "2022-09-04T14:36:02.190926Z",
"structure_string": "Mo2 W2 S8\n1.0\n3.192042 -0.000000 0.000000\n-1.596021 2.764352 0.000036\n0.000000 0.000501 32.958080\nMo W S\n2 2 8\ndirect\n0.333366 0.666731 0.091370 Mo\n0.666633 0.333267 0.280700 Mo\n0.333363 0.666726 0.470318 W\n0.666612 0.333225 0.660526 W\n0.333321 0.666643 0.328225 S\n0.333255 0.666512 0.708295 S\n0.666723 0.333446 0.043880 S\n0.666720 0.333440 0.422514 S\n0.666683 0.333367 0.138903 S\n0.666702 0.333405 0.518123 S\n0.333326 0.666653 0.233175 S\n0.333289 0.666580 0.612720 S\n",
"nsites": 12,
"nelements": 3,
"elements": [
"Mo",
"W",
"S"
],
"chemical_system": "Mo-S-W",
"density": 4.659700335419321,
"density_atomic": 0.04126267718215632,
"volume": 290.81971455767035,
"volume_molar": 14.594643807077599,
"formula_full": "Mo2 W2 S8",
"formula_reduced": "MoWS4",
"formula_anonymous": "ABC4",
"energy_above_hull": 3.8313109833333328,
"spacegroup": 156
},
{
"id": "jvasp-92260",
"created_at": "2022-09-04T14:36:02.188465Z",
"updated_at": "2022-09-04T14:36:02.188484Z",
"structure_string": "Fe6 C2\n1.0\n0.000005 -0.000003 -4.297259\n-2.319407 -4.017336 0.000000\n-2.319338 4.017297 -0.000002\nFe C\n6 2\ndirect\n0.500000 0.681073 -0.000000 Fe\n0.499992 0.318927 0.318919 Fe\n0.500008 0.000007 0.681081 Fe\n-0.000000 0.318961 0.000000 Fe\n0.999988 0.681088 0.681070 Fe\n0.000012 0.000018 0.318930 Fe\n0.250007 0.666687 0.333347 C\n0.749993 0.333339 0.666654 C\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Fe",
"C"
],
"chemical_system": "C-Fe",
"density": 7.446051302044047,
"density_atomic": 0.099899176783597,
"volume": 80.0807399777649,
"volume_molar": 6.028218603888244,
"formula_full": "Fe6 C2",
"formula_reduced": "Fe3C",
"formula_anonymous": "AB3",
"energy_above_hull": 4.083439125,
"spacegroup": 182
},
{
"id": "jvasp-90111",
"created_at": "2022-09-04T14:36:02.188179Z",
"updated_at": "2022-09-04T14:36:02.188202Z",
"structure_string": "Yb2 Ge6 Pt1\n1.0\n4.182932 0.000000 0.000000\n0.000000 3.973959 -0.000000\n0.000000 -1.986978 11.283348\nYb Ge Pt\n2 6 1\ndirect\n0.000000 0.001343 0.002685 Yb\n0.000000 0.665589 0.331178 Yb\n0.000000 0.284361 0.568724 Ge\n0.000000 0.396063 0.792126 Ge\n0.500000 0.543720 0.087438 Ge\n0.500000 0.110268 0.220536 Ge\n0.500000 0.899884 0.799770 Ge\n0.500000 0.788233 0.576466 Ge\n0.500000 0.218538 0.437075 Pt\n",
"nsites": 9,
"nelements": 3,
"elements": [
"Yb",
"Ge",
"Pt"
],
"chemical_system": "Ge-Pt-Yb",
"density": 8.649744311635525,
"density_atomic": 0.04798442997225359,
"volume": 187.56084015594516,
"volume_molar": 12.5501975609218,
"formula_full": "Yb2 Ge6 Pt1",
"formula_reduced": "Yb2Ge6Pt",
"formula_anonymous": "AB2C6",
"energy_above_hull": 0.7180476111111112,
"spacegroup": 38
},
{
"id": "jvasp-105720",
"created_at": "2022-09-04T14:36:02.186765Z",
"updated_at": "2022-09-04T14:36:02.186793Z",
"structure_string": "Ba2 Br6\n1.0\n6.860426 0.000000 0.000000\n-3.430213 5.941303 -0.000000\n-0.000000 -0.000000 6.059049\nBa Br\n2 6\ndirect\n0.333333 0.666667 0.750000 Ba\n0.666667 0.333333 0.250000 Ba\n0.171670 0.343338 0.250000 Br\n0.656663 0.828330 0.250000 Br\n0.171670 0.828330 0.250000 Br\n0.828331 0.656662 0.750000 Br\n0.343338 0.171669 0.750000 Br\n0.828331 0.171669 0.750000 Br\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Ba",
"Br"
],
"chemical_system": "Ba-Br",
"density": 5.0702353361121455,
"density_atomic": 0.03239311677672075,
"volume": 246.96604698900677,
"volume_molar": 18.590803723857164,
"formula_full": "Ba2 Br6",
"formula_reduced": "BaBr3",
"formula_anonymous": "AB3",
"energy_above_hull": 0.1607510262499999,
"spacegroup": 194
}
]
}