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&page=718",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=volume&page=716",
"results": [
{
"id": "jvasp-67857",
"created_at": "2022-09-04T14:35:51.509377Z",
"updated_at": "2022-09-04T14:35:51.509412Z",
"structure_string": "Na1 Mg1 Be1\n1.0\n-1.593078 1.593078 6.034049\n1.593078 -1.593078 6.034049\n1.593078 1.593078 -6.034049\nNa Mg Be\n1 1 1\ndirect\n0.647910 0.647910 0.000000 Na\n0.371022 0.371022 0.000000 Mg\n0.981068 0.981068 0.000000 Be\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Na",
"Mg",
"Be"
],
"chemical_system": "Be-Mg-Na",
"density": 1.526399469686772,
"density_atomic": 0.04897544045623768,
"volume": 61.255191827844186,
"volume_molar": 12.29624624893598,
"formula_full": "Na1 Mg1 Be1",
"formula_reduced": "NaMgBe",
"formula_anonymous": "ABC",
"energy_above_hull": 0.2606541833333332,
"spacegroup": 107
},
{
"id": "jvasp-67402",
"created_at": "2022-09-04T14:35:45.731720Z",
"updated_at": "2022-09-04T14:35:45.731746Z",
"structure_string": "Be2 Sb1 Pd1\n1.0\n3.070512 -0.000000 -0.000000\n0.000000 3.070512 -0.000000\n-0.000000 0.000000 6.497395\nBe Sb Pd\n2 1 1\ndirect\n0.000000 -0.000000 0.832530 Be\n0.000000 -0.000000 0.167470 Be\n0.500000 0.500000 0.500000 Sb\n0.500000 0.500000 0.000000 Pd\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Be",
"Sb",
"Pd"
],
"chemical_system": "Be-Pd-Sb",
"density": 6.673965789438071,
"density_atomic": 0.06529788631254307,
"volume": 61.25772556946671,
"volume_molar": 9.22256615041949,
"formula_full": "Be2 Sb1 Pd1",
"formula_reduced": "Be2SbPd",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.759686,
"spacegroup": 123
},
{
"id": "jvasp-36624",
"created_at": "2022-09-04T14:37:29.860262Z",
"updated_at": "2022-09-04T14:37:29.860272Z",
"structure_string": "Ca1 Os1 O3\n1.0\n3.942119 -0.000000 -0.000000\n-0.000000 3.942119 -0.000000\n0.000000 -0.000000 3.942119\nCa Os O\n1 1 3\ndirect\n0.000000 0.000000 0.000000 Ca\n0.500000 0.500000 0.500000 Os\n0.500000 0.500000 0.000000 O\n0.500000 0.000000 0.500000 O\n0.000000 0.500000 0.500000 O\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Ca",
"Os",
"O"
],
"chemical_system": "Ca-O-Os",
"density": 7.543671855561509,
"density_atomic": 0.08161703508067931,
"volume": 61.26172060841767,
"volume_molar": 7.3785340940736805,
"formula_full": "Ca1 Os1 O3",
"formula_reduced": "CaOsO3",
"formula_anonymous": "ABC3",
"energy_above_hull": 2.361831184,
"spacegroup": 221
},
{
"id": "jvasp-118638",
"created_at": "2022-09-04T14:38:27.808510Z",
"updated_at": "2022-09-04T14:38:27.808540Z",
"structure_string": "Li2 Sb1\n1.0\n3.260598 -0.454916 -0.096131\n-2.266246 -4.269467 -0.154806\n-0.450329 -2.339672 -4.200294\nLi Sb\n2 1\ndirect\n0.135449 0.432585 0.326746 Li\n0.750408 0.660389 0.712846 Li\n0.942931 0.046495 0.019794 Sb\n",
"nsites": 3,
"nelements": 2,
"elements": [
"Li",
"Sb"
],
"chemical_system": "Li-Sb",
"density": 3.6764633113436087,
"density_atomic": 0.048967531223820256,
"volume": 61.2650857623929,
"volume_molar": 12.298232337820064,
"formula_full": "Li2 Sb1",
"formula_reduced": "Li2Sb",
"formula_anonymous": "AB2",
"energy_above_hull": 0.6732920333333334,
"spacegroup": 71
},
{
"id": "jvasp-41814",
"created_at": "2022-09-04T14:37:35.102034Z",
"updated_at": "2022-09-04T14:37:35.102057Z",
"structure_string": "Pa1 Ga1 Fe2\n1.0\n-0.000166 3.129003 3.129512\n3.128650 0.000006 3.129339\n3.128629 3.128809 0.000028\nPa Ga Fe\n1 1 2\ndirect\n0.750000 0.749994 0.750000 Pa\n0.250010 0.249993 0.249998 Ga\n0.999967 0.999976 0.000006 Fe\n0.500024 0.500036 0.499994 Fe\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Pa",
"Ga",
"Fe"
],
"chemical_system": "Fe-Ga-Pa",
"density": 11.17808511609549,
"density_atomic": 0.0652842136651223,
"volume": 61.27055493871983,
"volume_molar": 9.2244976571071,
"formula_full": "Pa1 Ga1 Fe2",
"formula_reduced": "PaGaFe2",
"formula_anonymous": "ABC2",
"energy_above_hull": 2.74334660625,
"spacegroup": 225
},
{
"id": "jvasp-68165",
"created_at": "2022-09-04T14:36:10.609336Z",
"updated_at": "2022-09-04T14:36:10.609362Z",
"structure_string": "Be1 Ru2 Pb1\n1.0\n-1.954565 1.954565 4.009733\n1.954565 -1.954565 4.009733\n1.954565 1.954565 -4.009733\nBe Ru Pb\n1 2 1\ndirect\n0.500000 0.500000 0.000000 Be\n0.000000 0.000000 0.000000 Ru\n0.250000 0.750001 0.500001 Ru\n0.750001 0.250000 0.500001 Pb\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Be",
"Ru",
"Pb"
],
"chemical_system": "Be-Pb-Ru",
"density": 11.337451819492788,
"density_atomic": 0.0652806259203862,
"volume": 61.27392229477471,
"volume_molar": 9.225004624410888,
"formula_full": "Be1 Ru2 Pb1",
"formula_reduced": "BeRu2Pb",
"formula_anonymous": "ABC2",
"energy_above_hull": 2.91862948,
"spacegroup": 119
},
{
"id": "jvasp-116081",
"created_at": "2022-09-04T14:38:41.070777Z",
"updated_at": "2022-09-04T14:38:41.070807Z",
"structure_string": "Tl1 Zn1 F1\n1.0\n4.816167 -0.000000 -0.000000\n-2.408083 4.170923 -0.000000\n-0.000000 -0.000000 3.050375\nTl Zn F\n1 1 1\ndirect\n0.333335 0.666666 0.000000 Tl\n0.666668 0.333333 0.000000 Zn\n0.000000 0.000000 0.000000 F\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Tl",
"Zn",
"F"
],
"chemical_system": "F-Tl-Zn",
"density": 7.8260994576234815,
"density_atomic": 0.04895919989420422,
"volume": 61.27551117017211,
"volume_molar": 12.300325113590958,
"formula_full": "Tl1 Zn1 F1",
"formula_reduced": "TlZnF",
"formula_anonymous": "ABC",
"energy_above_hull": 0.0403133333333333,
"spacegroup": 187
},
{
"id": "jvasp-17186",
"created_at": "2022-09-04T14:38:15.073264Z",
"updated_at": "2022-09-04T14:38:15.073291Z",
"structure_string": "Hf2 Ag1\n1.0\n3.100231 -0.000000 -0.817545\n-0.215590 3.092726 -0.817545\n0.023982 0.025712 6.377943\nHf Ag\n2 1\ndirect\n0.334777 0.334778 0.669555 Hf\n0.665222 0.665223 0.330443 Hf\n0.000000 0.000000 0.000000 Ag\n",
"nsites": 3,
"nelements": 2,
"elements": [
"Hf",
"Ag"
],
"chemical_system": "Ag-Hf",
"density": 12.595617636060066,
"density_atomic": 0.04895313075733445,
"volume": 61.28310801757091,
"volume_molar": 12.301850089736552,
"formula_full": "Hf2 Ag1",
"formula_reduced": "Hf2Ag",
"formula_anonymous": "AB2",
"energy_above_hull": 3.1199377533333337,
"spacegroup": 139
},
{
"id": "jvasp-67799",
"created_at": "2022-09-04T14:35:43.815071Z",
"updated_at": "2022-09-04T14:35:43.815100Z",
"structure_string": "Hf1 Be2 In1\n1.0\n4.091582 0.000000 0.000000\n0.000000 4.091582 -0.000000\n0.000000 0.000000 3.660867\nHf Be In\n1 2 1\ndirect\n0.500000 0.500000 0.500000 Hf\n0.500000 0.000000 0.000000 Be\n0.000000 0.500000 0.000000 Be\n0.000000 0.000000 0.500000 In\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Hf",
"Be",
"In"
],
"chemical_system": "Be-Hf-In",
"density": 8.435423610947444,
"density_atomic": 0.06526698056088784,
"volume": 61.28673282607862,
"volume_molar": 9.22693329497895,
"formula_full": "Hf1 Be2 In1",
"formula_reduced": "HfBe2In",
"formula_anonymous": "ABC2",
"energy_above_hull": 2.1797412925,
"spacegroup": 123
},
{
"id": "jvasp-75596",
"created_at": "2022-09-04T14:36:02.791394Z",
"updated_at": "2022-09-04T14:36:02.791421Z",
"structure_string": "Ti1 Ga1 As1\n1.0\n-0.000000 3.129307 3.129307\n3.129307 0.000000 3.129307\n3.129307 3.129307 0.000000\nTi Ga As\n1 1 1\ndirect\n0.000000 0.000000 0.000000 Ti\n0.750001 0.750001 0.750001 Ga\n0.500001 0.500001 0.500001 As\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Ti",
"Ga",
"As"
],
"chemical_system": "As-Ga-Ti",
"density": 5.215926831372403,
"density_atomic": 0.048949329157163074,
"volume": 61.28786750821059,
"volume_molar": 12.302805500489153,
"formula_full": "Ti1 Ga1 As1",
"formula_reduced": "TiGaAs",
"formula_anonymous": "ABC",
"energy_above_hull": 1.7732974694444446,
"spacegroup": 216
},
{
"id": "jvasp-109095",
"created_at": "2022-09-04T14:37:50.581127Z",
"updated_at": "2022-09-04T14:37:50.581145Z",
"structure_string": "Zr1 In1 Co2\n1.0\n3.832639 -0.000000 2.212775\n1.277546 3.613447 2.212775\n-0.000000 -0.000000 4.425551\nZr In Co\n1 1 2\ndirect\n0.000000 0.000000 0.000000 Zr\n0.500000 0.500000 0.500001 In\n0.750001 0.750001 0.750001 Co\n0.250000 0.250000 0.250000 Co\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Zr",
"In",
"Co"
],
"chemical_system": "Co-In-Zr",
"density": 8.775751991443858,
"density_atomic": 0.06526390228494994,
"volume": 61.289623512482066,
"volume_molar": 9.227368497989316,
"formula_full": "Zr1 In1 Co2",
"formula_reduced": "ZrInCo2",
"formula_anonymous": "ABC2",
"energy_above_hull": 2.5195290675,
"spacegroup": 225
},
{
"id": "jvasp-71175",
"created_at": "2022-09-04T14:35:50.526575Z",
"updated_at": "2022-09-04T14:35:50.526598Z",
"structure_string": "Mg1 Zr1 Be2\n1.0\n4.302228 -0.000000 -0.000000\n0.000000 4.302228 -0.000000\n0.000000 0.000000 3.311457\nMg Zr Be\n1 1 2\ndirect\n0.500000 0.500000 0.500000 Mg\n0.000000 0.000000 0.500000 Zr\n0.500000 0.000000 0.000000 Be\n0.000000 0.500000 0.000000 Be\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Mg",
"Zr",
"Be"
],
"chemical_system": "Be-Mg-Zr",
"density": 3.618244946897923,
"density_atomic": 0.0652610454107559,
"volume": 61.29230653330518,
"volume_molar": 9.227772436215787,
"formula_full": "Mg1 Zr1 Be2",
"formula_reduced": "MgZrBe2",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.7983214375000005,
"spacegroup": 123
}
]
}