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=4355",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-updated_at&page=4353",
"results": [
{
"id": "jvasp-74226",
"created_at": "2022-09-04T14:35:50.295659Z",
"updated_at": "2022-09-04T14:35:50.295677Z",
"structure_string": "Sr1 Be1 Se2\n1.0\n-2.508081 2.508081 3.547086\n2.508081 -2.508081 3.547086\n2.508081 2.508081 -3.547086\nSr Be Se\n1 1 2\ndirect\n0.250000 0.750000 0.500000 Sr\n0.750000 0.250000 0.500000 Be\n0.000000 0.000000 0.000000 Se\n0.500001 0.500001 0.000000 Se\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Sr",
"Be",
"Se"
],
"chemical_system": "Be-Se-Sr",
"density": 4.735993478668856,
"density_atomic": 0.044817245961524844,
"volume": 89.25135657451955,
"volume_molar": 13.437105807817703,
"formula_full": "Sr1 Be1 Se2",
"formula_reduced": "SrBeSe2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.8788847858333331,
"spacegroup": 225
},
{
"id": "jvasp-65795",
"created_at": "2022-09-04T14:35:50.295488Z",
"updated_at": "2022-09-04T14:35:50.295510Z",
"structure_string": "Ba1 Na2 Si1\n1.0\n4.189362 -0.000000 -0.000000\n-0.000000 4.189362 -0.000000\n0.000000 0.000000 7.247506\nBa Na Si\n1 2 1\ndirect\n0.500000 0.500000 0.500000 Ba\n0.000000 0.000000 0.186454 Na\n0.000000 0.000000 0.813546 Na\n0.500000 0.500000 0.000000 Si\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ba",
"Na",
"Si"
],
"chemical_system": "Ba-Na-Si",
"density": 2.7596459181861723,
"density_atomic": 0.03144673997380034,
"volume": 127.19919468067518,
"volume_molar": 19.150286373141732,
"formula_full": "Ba1 Na2 Si1",
"formula_reduced": "BaNa2Si",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.4132856424999999,
"spacegroup": 123
},
{
"id": "jvasp-69590",
"created_at": "2022-09-04T14:35:50.294973Z",
"updated_at": "2022-09-04T14:35:50.294997Z",
"structure_string": "Be2 Zn1 Pb1\n1.0\n-1.968007 1.968007 4.174160\n1.968007 -1.968007 4.174160\n1.968007 1.968007 -4.174160\nBe Zn Pb\n2 1 1\ndirect\n0.000000 0.000000 0.000000 Be\n0.250000 0.750001 0.500001 Be\n0.750001 0.250000 0.500001 Zn\n0.500000 0.500000 0.000000 Pb\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Be",
"Zn",
"Pb"
],
"chemical_system": "Be-Pb-Zn",
"density": 7.462978753297328,
"density_atomic": 0.061855401510994036,
"volume": 64.66694746600342,
"volume_molar": 9.735836503994948,
"formula_full": "Be2 Zn1 Pb1",
"formula_reduced": "Be2ZnPb",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.85210614,
"spacegroup": 119
},
{
"id": "jvasp-49787",
"created_at": "2022-09-04T14:35:50.294673Z",
"updated_at": "2022-09-04T14:35:50.294693Z",
"structure_string": "Na1 Ti2 O3\n1.0\n1.527011 -2.644862 -0.000000\n1.527011 2.644862 0.000000\n-0.000000 0.000000 7.749526\nNa Ti O\n1 2 3\ndirect\n0.000000 0.000000 0.500000 Na\n0.666666 0.333333 0.149019 Ti\n0.333333 0.666666 0.850982 Ti\n0.666666 0.333333 0.704790 O\n0.000000 0.000000 0.000000 O\n0.333333 0.666666 0.295211 O\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Na",
"Ti",
"O"
],
"chemical_system": "Na-O-Ti",
"density": 4.422742055502064,
"density_atomic": 0.09585194558688974,
"volume": 62.596538476738615,
"volume_molar": 6.282752763261266,
"formula_full": "Na1 Ti2 O3",
"formula_reduced": "NaTi2O3",
"formula_anonymous": "AB2C3",
"energy_above_hull": 2.176676027777778,
"spacegroup": 164
},
{
"id": "jvasp-68686",
"created_at": "2022-09-04T14:35:50.294624Z",
"updated_at": "2022-09-04T14:35:50.294651Z",
"structure_string": "Mg1 Be2 V1\n1.0\n2.710174 0.000000 -0.000000\n0.000000 2.710174 0.000000\n0.000000 0.000000 6.752735\nMg Be V\n1 2 1\ndirect\n0.499999 0.499999 0.000000 Mg\n0.000000 0.000000 0.730814 Be\n0.000000 0.000000 0.269186 Be\n0.499999 0.499999 0.500000 V\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Mg",
"Be",
"V"
],
"chemical_system": "Be-Mg-V",
"density": 3.122633691842538,
"density_atomic": 0.08064657636576762,
"volume": 49.5991296872696,
"volume_molar": 7.467323513755808,
"formula_full": "Mg1 Be2 V1",
"formula_reduced": "MgBe2V",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.8386738625,
"spacegroup": 123
},
{
"id": "jvasp-93785",
"created_at": "2022-09-04T14:35:50.294300Z",
"updated_at": "2022-09-04T14:35:50.294322Z",
"structure_string": "Ce2 Al2 Ir2\n1.0\n-2.228689 -3.862625 -0.000000\n-2.228689 3.862625 0.000000\n0.000000 0.000000 -7.053443\nCe Al Ir\n2 2 2\ndirect\n0.000000 0.000000 0.500000 Ce\n0.000000 0.000000 0.000000 Ce\n0.666753 0.333247 0.250000 Al\n0.333247 0.666753 0.750000 Al\n0.666495 0.333505 0.750000 Ir\n0.333505 0.666495 0.250000 Ir\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Ce",
"Al",
"Ir"
],
"chemical_system": "Al-Ce-Ir",
"density": 9.826315626189093,
"density_atomic": 0.049406953671382585,
"volume": 121.44039561531012,
"volume_molar": 12.188852605758072,
"formula_full": "Ce2 Al2 Ir2",
"formula_reduced": "CeAlIr",
"formula_anonymous": "ABC",
"energy_above_hull": 2.2439164666666667,
"spacegroup": 194
},
{
"id": "jvasp-67908",
"created_at": "2022-09-04T14:35:50.287331Z",
"updated_at": "2022-09-04T14:35:50.287355Z",
"structure_string": "Ta1 Be1 W2\n1.0\n-2.111949 2.111949 3.416368\n2.111949 -2.111949 3.416368\n2.111949 2.111949 -3.416368\nTa Be W\n1 1 2\ndirect\n0.750000 0.250000 0.500000 Ta\n0.500000 0.500000 0.000000 Be\n0.000000 0.000000 0.000000 W\n0.250000 0.750000 0.500000 W\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ta",
"Be",
"W"
],
"chemical_system": "Be-Ta-W",
"density": 15.191881865857733,
"density_atomic": 0.06562487688490565,
"volume": 60.95249530167177,
"volume_molar": 9.176612659497652,
"formula_full": "Ta1 Be1 W2",
"formula_reduced": "TaBeW2",
"formula_anonymous": "ABC2",
"energy_above_hull": 6.130293825000001,
"spacegroup": 119
},
{
"id": "jvasp-105712",
"created_at": "2022-09-04T14:35:50.284910Z",
"updated_at": "2022-09-04T14:35:50.284930Z",
"structure_string": "Ac2 Tl1 Sn1\n1.0\n5.028182 -0.000000 2.903023\n1.676061 4.740616 2.903023\n-0.000000 -0.000000 5.806045\nAc Tl Sn\n2 1 1\ndirect\n0.749999 0.750001 0.749999 Ac\n0.250000 0.250000 0.250000 Ac\n0.000000 0.000000 0.000000 Tl\n0.500000 0.500000 0.499999 Sn\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ac",
"Tl",
"Sn"
],
"chemical_system": "Ac-Sn-Tl",
"density": 9.32386759231722,
"density_atomic": 0.028902394648334093,
"volume": 138.3968369634921,
"volume_molar": 20.83613082332301,
"formula_full": "Ac2 Tl1 Sn1",
"formula_reduced": "Ac2TlSn",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.185651075,
"spacegroup": 225
},
{
"id": "jvasp-105685",
"created_at": "2022-09-04T14:35:50.279550Z",
"updated_at": "2022-09-04T14:35:50.279569Z",
"structure_string": "Rb3 Dy1 Cl6\n1.0\n6.918504 0.000000 3.994400\n2.306168 6.522828 3.994400\n-0.000000 -0.000000 7.988800\nRb Dy Cl\n3 1 6\ndirect\n0.750000 0.750000 0.750000 Rb\n0.250000 0.250000 0.250000 Rb\n0.500000 0.500000 0.500000 Rb\n0.000000 0.000000 0.000000 Dy\n0.768420 0.231580 0.231580 Cl\n0.231580 0.231580 0.768420 Cl\n0.231580 0.768420 0.768420 Cl\n0.231580 0.768420 0.231580 Cl\n0.768420 0.231580 0.768420 Cl\n0.768420 0.768420 0.231580 Cl\n",
"nsites": 10,
"nelements": 3,
"elements": [
"Rb",
"Dy",
"Cl"
],
"chemical_system": "Cl-Dy-Rb",
"density": 2.9092179701805154,
"density_atomic": 0.02773769242777871,
"volume": 360.5202569044717,
"volume_molar": 21.7110373391009,
"formula_full": "Rb3 Dy1 Cl6",
"formula_reduced": "Rb3DyCl6",
"formula_anonymous": "AB3C6",
"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-68452",
"created_at": "2022-09-04T14:35:50.271188Z",
"updated_at": "2022-09-04T14:35:50.271220Z",
"structure_string": "Be1 Cu2 Br1\n1.0\n-1.714924 1.714924 5.862167\n1.714924 -1.714924 5.862167\n1.714924 1.714924 -5.862167\nBe Cu Br\n1 2 1\ndirect\n0.500000 0.500000 0.000000 Be\n0.000000 0.000000 0.000000 Cu\n0.250000 0.749999 0.499999 Cu\n0.749999 0.250000 0.499999 Br\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Be",
"Cu",
"Br"
],
"chemical_system": "Be-Br-Cu",
"density": 5.201293548904693,
"density_atomic": 0.05800321377901979,
"volume": 68.96169607496526,
"volume_molar": 10.38242602029451,
"formula_full": "Be1 Cu2 Br1",
"formula_reduced": "BeCu2Br",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.3559977762499999,
"spacegroup": 119
},
{
"id": "jvasp-95045",
"created_at": "2022-09-04T14:35:50.263969Z",
"updated_at": "2022-09-04T14:35:50.263987Z",
"structure_string": "Sc2 Al2 Ge2\n1.0\n3.939759 -0.000000 0.000000\n-1.969880 5.009020 -0.000000\n-0.000000 -0.000000 5.523203\nSc Al Ge\n2 2 2\ndirect\n0.316273 0.632547 0.250000 Sc\n0.683727 0.367453 0.750000 Sc\n0.000000 0.000000 0.500000 Al\n0.000000 0.000000 0.000000 Al\n0.621059 0.242119 0.250000 Ge\n0.378941 0.757881 0.750000 Ge\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Sc",
"Al",
"Ge"
],
"chemical_system": "Al-Ge-Sc",
"density": 4.405206058716261,
"density_atomic": 0.05504752821716015,
"volume": 108.99671964071223,
"volume_molar": 10.93989313424376,
"formula_full": "Sc2 Al2 Ge2",
"formula_reduced": "ScAlGe",
"formula_anonymous": "ABC",
"energy_above_hull": 1.302731333333333,
"spacegroup": 63
},
{
"id": "jvasp-96505",
"created_at": "2022-09-04T14:35:50.263496Z",
"updated_at": "2022-09-04T14:35:50.263523Z",
"structure_string": "Ta8 Fe2 S16\n1.0\n6.633617 -0.000000 -0.000000\n-3.316809 5.744881 -0.000000\n-0.000000 0.000000 11.699727\nTa Fe S\n8 2 16\ndirect\n0.493828 0.987655 0.750000 Ta\n0.506173 0.012345 0.250000 Ta\n0.987655 0.493827 0.250000 Ta\n0.493828 0.506172 0.750000 Ta\n0.506173 0.493827 0.250000 Ta\n0.012345 0.506172 0.750000 Ta\n0.000000 0.000000 0.250000 Ta\n0.000000 0.000000 0.750000 Ta\n0.000000 0.000000 0.000000 Fe\n0.000000 0.000000 0.500000 Fe\n0.165151 0.834848 0.384411 S\n0.834849 0.165152 0.615589 S\n0.834849 0.669698 0.884411 S\n0.165152 0.330302 0.115589 S\n0.165152 0.330302 0.384411 S\n0.330302 0.165152 0.615589 S\n0.834849 0.669698 0.615589 S\n0.666667 0.333333 0.388319 S\n0.330302 0.165152 0.884411 S\n0.669698 0.834848 0.115589 S\n0.834849 0.165152 0.884411 S\n0.333333 0.666667 0.888319 S\n0.669698 0.834848 0.384411 S\n0.165151 0.834848 0.115589 S\n0.666667 0.333333 0.111681 S\n0.333333 0.666667 0.611681 S\n",
"nsites": 26,
"nelements": 3,
"elements": [
"Ta",
"Fe",
"S"
],
"chemical_system": "Fe-S-Ta",
"density": 7.7178671505449055,
"density_atomic": 0.05831310801645139,
"volume": 445.86887724565867,
"volume_molar": 10.327250535678914,
"formula_full": "Ta8 Fe2 S16",
"formula_reduced": "Ta4FeS8",
"formula_anonymous": "AB4C8",
"energy_above_hull": 4.21036786923077,
"spacegroup": 194
}
]
}