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=611",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-volume_molar&page=609",
"results": [
{
"id": "jvasp-105863",
"created_at": "2022-09-04T14:35:59.937664Z",
"updated_at": "2022-09-04T14:35:59.937691Z",
"structure_string": "Sr1 Ce1 Hg2\n1.0\n4.752680 0.000000 2.743961\n1.584227 4.480869 2.743961\n0.000000 0.000000 5.487921\nSr Ce Hg\n1 1 2\ndirect\n0.000000 0.000000 0.000000 Sr\n0.500000 0.500000 0.499999 Ce\n0.250000 0.250000 0.250000 Hg\n0.750001 0.750000 0.749999 Hg\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Sr",
"Ce",
"Hg"
],
"chemical_system": "Ce-Hg-Sr",
"density": 8.935792362839145,
"density_atomic": 0.03422561959291658,
"volume": 116.87151460153113,
"volume_molar": 17.595417794120397,
"formula_full": "Sr1 Ce1 Hg2",
"formula_reduced": "SrCeHg2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-109057",
"created_at": "2022-09-04T14:38:15.808326Z",
"updated_at": "2022-09-04T14:38:15.808346Z",
"structure_string": "La1 Sm1 Mg2\n1.0\n4.752679 -0.000000 2.743960\n1.584227 4.480868 2.743960\n0.000000 -0.000000 5.487921\nLa Sm Mg\n1 1 2\ndirect\n0.500000 0.500000 0.500000 La\n0.000000 0.000000 0.000000 Sm\n0.250000 0.250000 0.250000 Mg\n0.750000 0.750000 0.750000 Mg\n",
"nsites": 4,
"nelements": 3,
"elements": [
"La",
"Sm",
"Mg"
],
"chemical_system": "La-Mg-Sm",
"density": 4.800619404612273,
"density_atomic": 0.03422563443241757,
"volume": 116.87146392854915,
"volume_molar": 17.595410165124637,
"formula_full": "La1 Sm1 Mg2",
"formula_reduced": "LaSmMg2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.3933704937499999,
"spacegroup": 225
},
{
"id": "jvasp-3081",
"created_at": "2022-09-04T14:37:00.216397Z",
"updated_at": "2022-09-04T14:37:00.216423Z",
"structure_string": "Na2 Al2 Te4\n1.0\n5.980730 0.000000 3.414764\n2.990365 5.825779 1.707382\n0.101752 0.000000 6.766594\nNa Al Te\n2 2 4\ndirect\n0.250000 -0.000000 -0.000000 Na\n0.750000 -0.000000 -0.000000 Na\n0.249999 0.500000 0.500000 Al\n0.749999 0.500000 0.499999 Al\n0.174658 0.500000 0.150684 Te\n0.325341 0.849316 0.500000 Te\n0.674658 0.150684 0.499999 Te\n0.825341 0.500000 0.849315 Te\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Na",
"Al",
"Te"
],
"chemical_system": "Al-Na-Te",
"density": 4.336000493842266,
"density_atomic": 0.03422602930762968,
"volume": 233.7402310999786,
"volume_molar": 17.59520716198751,
"formula_full": "Na2 Al2 Te4",
"formula_reduced": "NaAlTe2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.5155868333333335,
"spacegroup": 140
},
{
"id": "jvasp-20647",
"created_at": "2022-09-04T14:38:10.454672Z",
"updated_at": "2022-09-04T14:38:10.454688Z",
"structure_string": "U1 Te1\n1.0\n3.772043 0.000000 2.177790\n1.257347 3.556317 2.177790\n0.000000 0.000000 4.355581\nU Te\n1 1\ndirect\n0.500000 0.500000 0.500000 U\n0.000000 0.000000 0.000000 Te\n",
"nsites": 2,
"nelements": 2,
"elements": [
"U",
"Te"
],
"chemical_system": "Te-U",
"density": 10.391217372475717,
"density_atomic": 0.03422999221064413,
"volume": 58.42829258307812,
"volume_molar": 17.59317011508802,
"formula_full": "U1 Te1",
"formula_reduced": "UTe",
"formula_anonymous": "AB",
"energy_above_hull": 2.0873018833333337,
"spacegroup": 225
},
{
"id": "jvasp-78737",
"created_at": "2022-09-04T14:37:12.042178Z",
"updated_at": "2022-09-04T14:37:12.042210Z",
"structure_string": "U1 Te1\n1.0\n-3.079858 -3.079858 0.000000\n-3.079858 0.000000 -3.079858\n0.000000 -3.079858 -3.079858\nU Te\n1 1\ndirect\n0.000000 0.000000 0.000000 U\n0.500000 0.500000 0.500000 Te\n",
"nsites": 2,
"nelements": 2,
"elements": [
"U",
"Te"
],
"chemical_system": "Te-U",
"density": 10.391244160234352,
"density_atomic": 0.03423008045292957,
"volume": 58.428141959825005,
"volume_molar": 17.593124761366422,
"formula_full": "U1 Te1",
"formula_reduced": "UTe",
"formula_anonymous": "AB",
"energy_above_hull": 2.0873118833333333,
"spacegroup": 225
},
{
"id": "jvasp-8049",
"created_at": "2022-09-04T14:37:04.312138Z",
"updated_at": "2022-09-04T14:37:04.312153Z",
"structure_string": "Cd2 Sn2 As4\n1.0\n5.638208 -0.000000 -2.566530\n-1.168292 5.515839 -2.566530\n0.011477 0.014162 7.501543\nCd Sn As\n2 2 4\ndirect\n0.250001 0.750000 0.500000 Cd\n0.000000 0.000000 0.000000 Cd\n0.500000 0.500000 0.000000 Sn\n0.750001 0.250000 0.500000 Sn\n0.872971 0.875000 0.250000 As\n0.625001 0.127030 0.750000 As\n0.377030 0.375000 0.250000 As\n0.125001 0.622970 0.750000 As\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Cd",
"Sn",
"As"
],
"chemical_system": "As-Cd-Sn",
"density": 5.413743089488727,
"density_atomic": 0.03423137705290424,
"volume": 233.70371538475015,
"volume_molar": 17.592458377274287,
"formula_full": "Cd2 Sn2 As4",
"formula_reduced": "CdSnAs2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.7611762375,
"spacegroup": 122
},
{
"id": "jvasp-28731",
"created_at": "2022-09-04T14:37:33.807452Z",
"updated_at": "2022-09-04T14:37:33.807478Z",
"structure_string": "Te2 Mo3 W1 Se4 S2\n1.0\n3.350475 -0.000015 -0.000013\n-1.675251 2.901606 0.000007\n-0.000151 0.000112 36.058337\nTe Mo W Se S\n2 3 1 4 2\ndirect\n0.666665 0.333353 0.414854 Te\n0.666676 0.333332 0.520821 Te\n0.333333 0.666672 0.099407 Mo\n0.666679 0.333358 0.274876 Mo\n0.666643 0.333285 0.660815 Mo\n0.333342 0.666682 0.467852 W\n0.333356 0.666691 0.321060 Se\n0.333319 0.666616 0.706956 Se\n0.333344 0.666704 0.228670 Se\n0.333311 0.666636 0.614594 Se\n0.666661 0.333347 0.057352 S\n0.666663 0.333319 0.141492 S\n",
"nsites": 12,
"nelements": 5,
"elements": [
"Te",
"Mo",
"W",
"Se",
"S"
],
"chemical_system": "Mo-S-Se-Te-W",
"density": 5.243009278744656,
"density_atomic": 0.034231966853263185,
"volume": 350.5495331728534,
"volume_molar": 17.592155267660107,
"formula_full": "Te2 Mo3 W1 Se4 S2",
"formula_reduced": "Te2Mo3W(Se2S)2",
"formula_anonymous": "AB2C2D3E4",
"energy_above_hull": 3.725533891666667,
"spacegroup": 156
},
{
"id": "jvasp-110668",
"created_at": "2022-09-04T14:38:37.530663Z",
"updated_at": "2022-09-04T14:38:37.530696Z",
"structure_string": "K2 Li1 Mo1 Br6\n1.0\n6.449971 -0.000000 3.723893\n2.149990 6.081091 3.723893\n-0.000000 -0.000000 7.447785\nK Li Mo Br\n2 1 1 6\ndirect\n0.750000 0.750000 0.750000 K\n0.250000 0.250000 0.250000 K\n0.500000 0.500000 0.500000 Li\n0.000000 0.000000 0.000000 Mo\n0.753416 0.246584 0.246584 Br\n0.246584 0.246584 0.753417 Br\n0.246584 0.753416 0.753417 Br\n0.246584 0.753416 0.246584 Br\n0.753416 0.246584 0.753417 Br\n0.753416 0.753416 0.246583 Br\n",
"nsites": 10,
"nelements": 4,
"elements": [
"K",
"Li",
"Mo",
"Br"
],
"chemical_system": "Br-K-Li-Mo",
"density": 3.7545386200556914,
"density_atomic": 0.03423210491336461,
"volume": 292.12343282156405,
"volume_molar": 17.592084317458625,
"formula_full": "K2 Li1 Mo1 Br6",
"formula_reduced": "K2LiMoBr6",
"formula_anonymous": "ABC2D6",
"energy_above_hull": 0.389080653,
"spacegroup": 225
},
{
"id": "jvasp-40274",
"created_at": "2022-09-04T14:37:36.333753Z",
"updated_at": "2022-09-04T14:37:36.333777Z",
"structure_string": "Pm3 Sn1\n1.0\n4.888738 0.000000 -0.000000\n0.000000 4.888738 0.000000\n-0.000000 0.000000 4.888738\nPm Sn\n3 1\ndirect\n0.000000 0.500000 0.500000 Pm\n0.500000 0.500000 0.000000 Pm\n0.500000 0.000000 0.500000 Pm\n0.000000 0.000000 0.000000 Sn\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Pm",
"Sn"
],
"chemical_system": "Pm-Sn",
"density": 7.869391929980433,
"density_atomic": 0.03423495036342302,
"volume": 116.83966115147757,
"volume_molar": 17.59062214512254,
"formula_full": "Pm3 Sn1",
"formula_reduced": "Pm3Sn",
"formula_anonymous": "AB3",
"energy_above_hull": 1.17546130625,
"spacegroup": 221
},
{
"id": "jvasp-110847",
"created_at": "2022-09-04T14:38:36.525891Z",
"updated_at": "2022-09-04T14:38:36.525920Z",
"structure_string": "Pm6 Hg2\n1.0\n7.007413 0.000000 0.000000\n-3.503707 6.068597 0.000000\n-0.000000 -0.000000 5.495054\nPm Hg\n6 2\ndirect\n0.174392 0.348784 0.250000 Pm\n0.651216 0.825608 0.250000 Pm\n0.174392 0.825608 0.250000 Pm\n0.825607 0.651217 0.749999 Pm\n0.348783 0.174392 0.749999 Pm\n0.825607 0.174392 0.749999 Pm\n0.333333 0.666667 0.749999 Hg\n0.666666 0.333333 0.250000 Hg\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Pm",
"Hg"
],
"chemical_system": "Hg-Pm",
"density": 9.033128152829669,
"density_atomic": 0.034235132244533804,
"volume": 233.67808083397514,
"volume_molar": 17.590528691360706,
"formula_full": "Pm6 Hg2",
"formula_reduced": "Pm3Hg",
"formula_anonymous": "AB3",
"energy_above_hull": 1.0417191166666666,
"spacegroup": 194
},
{
"id": "jvasp-79490",
"created_at": "2022-09-04T14:36:43.011580Z",
"updated_at": "2022-09-04T14:36:43.011608Z",
"structure_string": "Pb2 Se2\n1.0\n-4.301447 0.000000 0.000000\n0.000000 0.000000 -4.485391\n2.150723 -6.055524 -0.000000\nPb Se\n2 2\ndirect\n0.629732 0.750000 0.259464 Pb\n0.370269 0.250000 0.740535 Pb\n0.864921 0.750000 0.729839 Se\n0.135080 0.250000 0.270160 Se\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Pb",
"Se"
],
"chemical_system": "Pb-Se",
"density": 8.134322880374594,
"density_atomic": 0.0342368167387706,
"volume": 116.83329178995497,
"volume_molar": 17.58966321533153,
"formula_full": "Pb2 Se2",
"formula_reduced": "PbSe",
"formula_anonymous": "AB",
"energy_above_hull": 0.2726670933333334,
"spacegroup": 63
},
{
"id": "jvasp-116120",
"created_at": "2022-09-04T14:38:40.662951Z",
"updated_at": "2022-09-04T14:38:40.662977Z",
"structure_string": "Rb1 Ge1 Se1\n1.0\n5.945191 -0.000000 0.000000\n-2.972595 5.148686 -0.000000\n0.000000 -0.000000 2.862143\nRb Ge Se\n1 1 1\ndirect\n0.333333 0.666667 0.000000 Rb\n0.000000 0.000000 0.000000 Ge\n0.666667 0.333333 0.000000 Se\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Rb",
"Ge",
"Se"
],
"chemical_system": "Ge-Rb-Se",
"density": 4.493327981885951,
"density_atomic": 0.03424267690143718,
"volume": 87.60997303555109,
"volume_molar": 17.586652986663108,
"formula_full": "Rb1 Ge1 Se1",
"formula_reduced": "RbGeSe",
"formula_anonymous": "ABC",
"energy_above_hull": 0.3853064388888889,
"spacegroup": 187
}
]
}