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=-formula_anonymous&page=1091",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-formula_anonymous&page=1089",
"results": [
{
"id": "jvasp-36307",
"created_at": "2022-09-04T14:36:45.033254Z",
"updated_at": "2022-09-04T14:36:45.033278Z",
"structure_string": "Be2 Sn2 P4\n1.0\n5.437394 0.000000 -0.000000\n0.000000 5.437394 -0.000000\n-2.718697 -2.718697 5.463312\nBe Sn P\n2 2 4\ndirect\n0.500000 0.500000 0.000000 Be\n0.749999 0.249999 0.500000 Be\n0.000000 0.000000 0.000000 Sn\n0.249999 0.749999 0.500000 Sn\n0.819598 0.874999 0.250000 P\n0.124999 0.569598 0.750000 P\n0.624999 0.180401 0.750000 P\n0.430401 0.375000 0.250000 P\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Be",
"Sn",
"P"
],
"chemical_system": "Be-P-Sn",
"density": 3.89977412915977,
"density_atomic": 0.0495281808390054,
"volume": 161.5242042909778,
"volume_molar": 12.159018679840804,
"formula_full": "Be2 Sn2 P4",
"formula_reduced": "BeSnP2",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.9760997,
"spacegroup": 122
},
{
"id": "jvasp-49772",
"created_at": "2022-09-04T14:36:45.035046Z",
"updated_at": "2022-09-04T14:36:45.035067Z",
"structure_string": "Li1 Zn1 O2\n1.0\n1.493215 0.862108 4.793756\n-1.493215 0.862108 4.793756\n-0.000000 -1.724216 4.793756\nLi Zn O\n1 1 2\ndirect\n0.500000 0.500000 0.500000 Li\n0.000000 0.000000 0.000000 Zn\n0.253445 0.253445 0.253445 O\n0.746555 0.746555 0.746555 O\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Li",
"Zn",
"O"
],
"chemical_system": "Li-O-Zn",
"density": 4.679779193169676,
"density_atomic": 0.10803109968385342,
"volume": 37.02637492079375,
"volume_molar": 5.574451040138845,
"formula_full": "Li1 Zn1 O2",
"formula_reduced": "LiZnO2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.6155143499999999,
"spacegroup": 166
},
{
"id": "jvasp-99601",
"created_at": "2022-09-04T14:36:54.041585Z",
"updated_at": "2022-09-04T14:36:54.041603Z",
"structure_string": "Mn1 V2 Fe1\n1.0\n3.507010 -0.000000 2.024773\n1.169003 3.306441 2.024773\n-0.000000 -0.000000 4.049547\nMn V Fe\n1 2 1\ndirect\n0.000000 0.000000 0.000000 Mn\n0.250000 0.250000 0.250000 V\n0.749999 0.750000 0.750000 V\n0.499999 0.500000 0.500000 Fe\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Mn",
"V",
"Fe"
],
"chemical_system": "Fe-Mn-V",
"density": 7.520436113570448,
"density_atomic": 0.08518355597041274,
"volume": 46.957419826302406,
"volume_molar": 7.069604798010197,
"formula_full": "Mn1 V2 Fe1",
"formula_reduced": "MnV2Fe",
"formula_anonymous": "ABC2",
"energy_above_hull": 4.037370285344828,
"spacegroup": 225
},
{
"id": "jvasp-12059",
"created_at": "2022-09-04T14:36:44.976852Z",
"updated_at": "2022-09-04T14:36:44.976877Z",
"structure_string": "Cu2 H2 O4\n1.0\n-2.796586 0.000000 0.000000\n0.000000 0.000000 -4.389456\n0.000000 -5.665114 0.000000\nCu H O\n2 2 4\ndirect\n0.500001 0.785756 0.237274 Cu\n0.000000 0.285755 0.762725 Cu\n0.000000 0.330081 0.262638 H\n0.500001 0.830082 0.737361 H\n0.500001 0.038952 0.646256 O\n0.000000 0.538953 0.353743 O\n0.500001 0.531603 0.865209 O\n0.000000 0.031603 0.134790 O\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Cu",
"H",
"O"
],
"chemical_system": "Cu-H-O",
"density": 4.611011051028997,
"density_atomic": 0.11503829970980937,
"volume": 69.54205703822512,
"volume_molar": 5.234900702801755,
"formula_full": "Cu2 H2 O4",
"formula_reduced": "CuHO2",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.5602043624999995,
"spacegroup": 31
},
{
"id": "jvasp-100978",
"created_at": "2022-09-04T14:36:44.988038Z",
"updated_at": "2022-09-04T14:36:44.988063Z",
"structure_string": "Hf1 Tc2 Mo1\n1.0\n3.896297 -0.000000 2.249528\n1.298766 3.673464 2.249528\n-0.000000 -0.000000 4.499056\nHf Tc Mo\n1 2 1\ndirect\n0.500001 0.499999 0.500001 Hf\n0.750002 0.749999 0.750001 Tc\n0.250001 0.250000 0.250000 Tc\n0.000000 0.000000 0.000000 Mo\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Hf",
"Tc",
"Mo"
],
"chemical_system": "Hf-Mo-Tc",
"density": 12.130951486148529,
"density_atomic": 0.06211703966801745,
"volume": 64.39456904865192,
"volume_molar": 9.69482897476303,
"formula_full": "Hf1 Tc2 Mo1",
"formula_reduced": "HfTc2Mo",
"formula_anonymous": "ABC2",
"energy_above_hull": 5.511680475,
"spacegroup": 225
},
{
"id": "jvasp-107228",
"created_at": "2022-09-04T14:36:45.002034Z",
"updated_at": "2022-09-04T14:36:45.002058Z",
"structure_string": "Tm2 Pt1 Rh1\n1.0\n4.170094 -0.000000 2.407605\n1.390031 3.931602 2.407605\n-0.000000 -0.000000 4.815209\nTm Pt Rh\n2 1 1\ndirect\n0.250000 0.250000 0.250000 Tm\n0.749999 0.750000 0.749999 Tm\n0.499999 0.500000 0.499999 Pt\n0.000000 0.000000 0.000000 Rh\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Tm",
"Pt",
"Rh"
],
"chemical_system": "Pt-Rh-Tm",
"density": 13.374533671098042,
"density_atomic": 0.050667497792303035,
"volume": 78.94607340581254,
"volume_molar": 11.885609162477392,
"formula_full": "Tm2 Pt1 Rh1",
"formula_reduced": "Tm2PtRh",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.7553282250000002,
"spacegroup": 225
},
{
"id": "jvasp-8774",
"created_at": "2022-09-04T14:36:45.027963Z",
"updated_at": "2022-09-04T14:36:45.027989Z",
"structure_string": "Li2 Y2 S4\n1.0\n7.677290 -0.000073 -0.000087\n7.677208 6.738633 0.062923\n3.838549 4.522150 3.197507\nLi Y S\n2 2 4\ndirect\n0.500008 0.000003 0.999982 Li\n0.249992 0.499997 0.000017 Li\n0.000007 -0.000004 0.999996 Y\n0.749993 0.500004 0.000004 Y\n0.246022 0.000001 0.507951 S\n0.996016 0.500000 0.507965 S\n0.753983 0.000001 0.492033 S\n0.503978 0.499999 0.492048 S\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Li",
"Y",
"S"
],
"chemical_system": "Li-S-Y",
"density": 3.2547362797726955,
"density_atomic": 0.04900829093770359,
"volume": 163.23768584726045,
"volume_molar": 12.288004018860779,
"formula_full": "Li2 Y2 S4",
"formula_reduced": "LiYS2",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.3396488625000005,
"spacegroup": 141
},
{
"id": "jvasp-99787",
"created_at": "2022-09-04T14:36:45.032965Z",
"updated_at": "2022-09-04T14:36:45.032974Z",
"structure_string": "Ho2 Zn1 Ga1\n1.0\n4.325039 -0.000000 2.497063\n1.441680 4.077686 2.497063\n-0.000000 -0.000000 4.994125\nHo Zn Ga\n2 1 1\ndirect\n0.250000 0.250000 0.249999 Ho\n0.750000 0.750001 0.749998 Ho\n0.000000 0.000000 0.000000 Zn\n0.500000 0.500000 0.499999 Ga\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ho",
"Zn",
"Ga"
],
"chemical_system": "Ga-Ho-Zn",
"density": 8.766615518871308,
"density_atomic": 0.04541473401530645,
"volume": 88.07714251176395,
"volume_molar": 13.260323748610563,
"formula_full": "Ho2 Zn1 Ga1",
"formula_reduced": "Ho2ZnGa",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.0680084645833332,
"spacegroup": 225
},
{
"id": "jvasp-18627",
"created_at": "2022-09-04T14:36:46.084493Z",
"updated_at": "2022-09-04T14:36:46.084508Z",
"structure_string": "Ba2 Zn2 Bi4\n1.0\n4.596168 0.000000 -0.989567\n-0.213056 4.591227 -0.989567\n0.239267 0.250628 12.279837\nBa Zn Bi\n2 2 4\ndirect\n0.879015 0.879016 0.758030 Ba\n0.120985 0.120985 0.241970 Ba\n0.250000 0.750001 0.500000 Zn\n0.750000 0.250000 0.500000 Zn\n-0.000000 0.500000 -0.000000 Bi\n0.678113 0.678113 0.356225 Bi\n0.500000 0.000000 -0.000000 Bi\n0.321887 0.321888 0.643774 Bi\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Ba",
"Zn",
"Bi"
],
"chemical_system": "Ba-Bi-Zn",
"density": 7.885643359249709,
"density_atomic": 0.030603318276473793,
"volume": 261.4095611373612,
"volume_molar": 19.678064664737686,
"formula_full": "Ba2 Zn2 Bi4",
"formula_reduced": "BaZnBi2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.103313575,
"spacegroup": 139
},
{
"id": "jvasp-106686",
"created_at": "2022-09-04T14:36:53.746456Z",
"updated_at": "2022-09-04T14:36:53.746486Z",
"structure_string": "Zn1 Hg1 Te2\n1.0\n4.508162 -0.000000 0.000000\n0.000000 4.508162 0.000000\n-0.000000 0.000000 6.449474\nZn Hg Te\n1 1 2\ndirect\n0.500000 0.500000 0.500000 Zn\n0.000000 0.000000 0.000000 Hg\n-0.000000 0.500000 0.272200 Te\n0.500000 0.000000 0.727799 Te\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Zn",
"Hg",
"Te"
],
"chemical_system": "Hg-Te-Zn",
"density": 6.602818311509002,
"density_atomic": 0.030516636676857792,
"volume": 131.0760436137246,
"volume_molar": 19.73395962264372,
"formula_full": "Zn1 Hg1 Te2",
"formula_reduced": "ZnHgTe2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.0,
"spacegroup": 115
},
{
"id": "jvasp-1549",
"created_at": "2022-09-04T14:36:46.108173Z",
"updated_at": "2022-09-04T14:36:46.108198Z",
"structure_string": "Rb1 Tm1 O2\n1.0\n3.327814 0.006644 5.914036\n1.554786 2.942283 5.914036\n0.011001 0.006644 6.786019\nRb Tm O\n1 1 2\ndirect\n0.000000 0.000000 0.000000 Rb\n0.500001 0.499998 0.500002 Tm\n0.775254 0.775250 0.775256 O\n0.224747 0.224746 0.224748 O\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Rb",
"Tm",
"O"
],
"chemical_system": "O-Rb-Tm",
"density": 7.193365021895773,
"density_atomic": 0.060501863405885065,
"volume": 66.11366617198962,
"volume_molar": 9.953645096184298,
"formula_full": "Rb1 Tm1 O2",
"formula_reduced": "RbTmO2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.5510178124999998,
"spacegroup": 166
},
{
"id": "jvasp-103696",
"created_at": "2022-09-04T14:36:53.417079Z",
"updated_at": "2022-09-04T14:36:53.417108Z",
"structure_string": "Mo2 C1 N1\n1.0\n2.824769 0.000000 0.000000\n0.000000 2.905658 0.000000\n-0.000000 0.000000 5.022527\nMo C N\n2 1 1\ndirect\n0.500000 0.500000 0.166344 Mo\n0.500000 0.000000 0.667072 Mo\n0.000000 0.000000 0.998474 C\n-0.000000 0.500000 0.501412 N\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Mo",
"C",
"N"
],
"chemical_system": "C-Mo-N",
"density": 8.777107775498868,
"density_atomic": 0.09703094852533516,
"volume": 41.2239606104189,
"volume_molar": 6.206412337015953,
"formula_full": "Mo2 C1 N1",
"formula_reduced": "Mo2CN",
"formula_anonymous": "ABC2",
"energy_above_hull": 5.6794012625,
"spacegroup": 25
}
]
}