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=900",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=formula_anonymous&page=898",
"results": [
{
"id": "jvasp-14922",
"created_at": "2022-09-04T14:35:55.813110Z",
"updated_at": "2022-09-04T14:35:55.813134Z",
"structure_string": "Ti4 N2\n1.0\n3.819335 -0.000000 -1.625127\n-0.691492 3.756215 -1.625127\n0.005262 0.006319 5.312985\nTi N\n4 2\ndirect\n0.857118 0.607120 0.714237 Ti\n0.607118 0.857120 0.214237 Ti\n0.392881 0.142882 0.785761 Ti\n0.142881 0.392882 0.285761 Ti\n0.624999 0.375001 0.249999 N\n0.375000 0.625001 0.749999 N\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Ti",
"N"
],
"chemical_system": "N-Ti",
"density": 4.776648769788689,
"density_atomic": 0.07863714536909946,
"volume": 76.29981952978808,
"volume_molar": 7.658137552849682,
"formula_full": "Ti4 N2",
"formula_reduced": "Ti2N",
"formula_anonymous": "AB2",
"energy_above_hull": 3.324356638888889,
"spacegroup": 141
},
{
"id": "jvasp-95069",
"created_at": "2022-09-04T14:35:55.862507Z",
"updated_at": "2022-09-04T14:35:55.862531Z",
"structure_string": "Nb2 Fe4\n1.0\n-3.392272 -3.392272 0.000000\n-3.392272 -0.000000 -3.392272\n0.000000 -3.392272 -3.392272\nNb Fe\n2 4\ndirect\n0.750000 0.750000 0.750000 Nb\n0.000000 0.000000 0.000000 Nb\n0.875000 0.375000 0.375000 Fe\n0.375000 0.875000 0.375000 Fe\n0.375000 0.375000 0.875000 Fe\n0.375000 0.375000 0.375000 Fe\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Nb",
"Fe"
],
"chemical_system": "Fe-Nb",
"density": 8.70312136313646,
"density_atomic": 0.07685095198402303,
"volume": 78.07320332541063,
"volume_molar": 7.836130333495382,
"formula_full": "Nb2 Fe4",
"formula_reduced": "NbFe2",
"formula_anonymous": "AB2",
"energy_above_hull": 3.6037868,
"spacegroup": 227
},
{
"id": "jvasp-95047",
"created_at": "2022-09-04T14:35:55.696581Z",
"updated_at": "2022-09-04T14:35:55.696599Z",
"structure_string": "Cr4 Fe2\n1.0\n-3.248975 -3.248975 0.000000\n-3.248975 -0.000000 -3.248975\n0.000000 -3.248975 -3.248975\nCr Fe\n4 2\ndirect\n0.874999 0.374999 0.374999 Cr\n0.374999 0.874999 0.374999 Cr\n0.374999 0.374999 0.874999 Cr\n0.374999 0.374999 0.374999 Cr\n0.749999 0.749999 0.749999 Fe\n0.000000 0.000000 0.000000 Fe\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Cr",
"Fe"
],
"chemical_system": "Cr-Fe",
"density": 7.739053550680173,
"density_atomic": 0.08747463640656816,
"volume": 68.59131111003373,
"volume_molar": 6.884442173626249,
"formula_full": "Cr4 Fe2",
"formula_reduced": "Cr2Fe",
"formula_anonymous": "AB2",
"energy_above_hull": 3.934126766666667,
"spacegroup": 227
},
{
"id": "jvasp-22677",
"created_at": "2022-09-04T14:35:55.767530Z",
"updated_at": "2022-09-04T14:35:55.767554Z",
"structure_string": "Ca1 O2\n1.0\n2.323349 2.323349 0.000000\n0.000000 2.323349 3.378620\n2.323349 0.000000 3.378620\nCa O\n1 2\ndirect\n0.500000 0.500000 0.500000 Ca\n0.112268 0.887732 0.887732 O\n0.887732 0.112268 0.112268 O\n",
"nsites": 3,
"nelements": 2,
"elements": [
"Ca",
"O"
],
"chemical_system": "Ca-O",
"density": 3.2813030819133844,
"density_atomic": 0.08224755694897527,
"volume": 36.47524754882555,
"volume_molar": 7.321969166495748,
"formula_full": "Ca1 O2",
"formula_reduced": "CaO2",
"formula_anonymous": "AB2",
"energy_above_hull": 1.2350978333333336,
"spacegroup": 139
},
{
"id": "jvasp-580",
"created_at": "2022-09-04T14:35:59.870686Z",
"updated_at": "2022-09-04T14:35:59.870703Z",
"structure_string": "Nb4 Se8\n1.0\n1.744942 -3.022328 0.000000\n1.744942 3.022328 0.000000\n0.000000 0.000000 25.539153\nNb Se\n4 8\ndirect\n0.000000 0.000000 0.000000 Nb\n0.000000 0.000000 0.248032 Nb\n0.666667 0.333332 0.500000 Nb\n0.000000 0.000000 0.751968 Nb\n0.666667 0.333332 0.934146 Se\n0.333332 0.666667 0.685834 Se\n0.333332 0.666667 0.314166 Se\n0.666667 0.333332 0.065854 Se\n0.333332 0.666667 0.817576 Se\n0.333332 0.666667 0.182424 Se\n0.000000 0.000000 0.434073 Se\n0.000000 0.000000 0.565927 Se\n",
"nsites": 12,
"nelements": 2,
"elements": [
"Nb",
"Se"
],
"chemical_system": "Nb-Se",
"density": 6.1847652892779115,
"density_atomic": 0.044547380326341625,
"volume": 269.376109483686,
"volume_molar": 13.518507072432735,
"formula_full": "Nb4 Se8",
"formula_reduced": "NbSe2",
"formula_anonymous": "AB2",
"energy_above_hull": 2.1611353777777778,
"spacegroup": 187
},
{
"id": "jvasp-18660",
"created_at": "2022-09-04T14:36:02.148192Z",
"updated_at": "2022-09-04T14:36:02.148220Z",
"structure_string": "Ce1 Hg2\n1.0\n2.535585 -4.391764 -0.000000\n2.535585 4.391764 -0.000000\n-0.000000 -0.000000 3.333850\nCe Hg\n1 2\ndirect\n0.000000 0.000000 0.000000 Ce\n0.333334 0.666668 0.500000 Hg\n0.666668 0.333334 0.500000 Hg\n",
"nsites": 3,
"nelements": 2,
"elements": [
"Ce",
"Hg"
],
"chemical_system": "Ce-Hg",
"density": 12.105721977152507,
"density_atomic": 0.0404043416761059,
"volume": 74.24944636021935,
"volume_molar": 14.904687244443688,
"formula_full": "Ce1 Hg2",
"formula_reduced": "CeHg2",
"formula_anonymous": "AB2",
"energy_above_hull": 0.0,
"spacegroup": 191
},
{
"id": "jvasp-5485",
"created_at": "2022-09-04T14:35:49.231542Z",
"updated_at": "2022-09-04T14:35:49.231570Z",
"structure_string": "Cd2 I4\n1.0\n2.142630 -3.711143 0.000000\n2.142630 3.711143 0.000000\n0.000000 0.000000 13.750837\nCd I\n2 4\ndirect\n0.666667 0.333333 0.500062 Cd\n0.333333 0.666667 0.000062 Cd\n0.000000 0.000000 0.373856 I\n0.000000 0.000000 0.873857 I\n0.333333 0.666667 0.626082 I\n0.666667 0.333333 0.126081 I\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Cd",
"I"
],
"chemical_system": "Cd-I",
"density": 5.56169386367612,
"density_atomic": 0.027437039601934627,
"volume": 218.68248495646486,
"volume_molar": 21.94894510257356,
"formula_full": "Cd2 I4",
"formula_reduced": "CdI2",
"formula_anonymous": "AB2",
"energy_above_hull": 0.0,
"spacegroup": 186
},
{
"id": "jvasp-93833",
"created_at": "2022-09-04T14:35:49.634942Z",
"updated_at": "2022-09-04T14:35:49.634979Z",
"structure_string": "W2 N4\n1.0\n-1.468227 -2.543048 0.000000\n-1.468227 2.543048 0.000000\n0.000000 -0.000000 -7.805727\nW N\n2 4\ndirect\n0.333329 0.666673 0.750000 W\n0.666673 0.333329 0.250000 W\n0.999997 0.000005 0.590030 N\n0.000005 0.999997 0.409970 N\n0.000005 0.999997 0.090030 N\n0.999997 0.000005 0.909970 N\n",
"nsites": 6,
"nelements": 2,
"elements": [
"W",
"N"
],
"chemical_system": "N-W",
"density": 12.070448679783823,
"density_atomic": 0.10293430411473374,
"volume": 58.28960570144056,
"volume_molar": 5.850470172982892,
"formula_full": "W2 N4",
"formula_reduced": "WN2",
"formula_anonymous": "AB2",
"energy_above_hull": 5.3089388333333325,
"spacegroup": 194
},
{
"id": "jvasp-93730",
"created_at": "2022-09-04T14:36:00.532490Z",
"updated_at": "2022-09-04T14:36:00.532520Z",
"structure_string": "Dy2 Cu4\n1.0\n-4.272811 -0.000000 -0.000000\n-2.136405 -3.394664 3.674281\n-2.136405 3.394664 3.674281\nDy Cu\n2 4\ndirect\n0.540460 0.709538 0.209539 Dy\n0.459538 0.290461 0.790461 Dy\n0.164899 0.288799 0.381401 Cu\n0.835099 0.711200 0.618599 Cu\n0.835100 0.118599 0.211200 Cu\n0.164898 0.881401 0.788799 Cu\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Dy",
"Cu"
],
"chemical_system": "Cu-Dy",
"density": 9.023038551805518,
"density_atomic": 0.056290928196211336,
"volume": 106.58911111015985,
"volume_molar": 10.698243843144375,
"formula_full": "Dy2 Cu4",
"formula_reduced": "DyCu2",
"formula_anonymous": "AB2",
"energy_above_hull": 0.1912373,
"spacegroup": 74
},
{
"id": "jvasp-93946",
"created_at": "2022-09-04T14:35:51.992005Z",
"updated_at": "2022-09-04T14:35:51.992031Z",
"structure_string": "La2 Al4\n1.0\n5.007811 -0.000000 2.891261\n1.669270 4.721409 2.891261\n0.000000 0.000000 5.782521\nLa Al\n2 4\ndirect\n0.875000 0.875000 0.874999 La\n0.125000 0.125000 0.125000 La\n0.500000 0.500000 0.500000 Al\n0.500000 0.500000 -0.000000 Al\n-0.000000 0.500000 0.500000 Al\n0.500000 -0.000000 0.500000 Al\n",
"nsites": 6,
"nelements": 2,
"elements": [
"La",
"Al"
],
"chemical_system": "Al-La",
"density": 4.684936731673582,
"density_atomic": 0.043884835867497925,
"volume": 136.7214866227569,
"volume_molar": 13.722600622644988,
"formula_full": "La2 Al4",
"formula_reduced": "LaAl2",
"formula_anonymous": "AB2",
"energy_above_hull": 1.3816402,
"spacegroup": 227
},
{
"id": "jvasp-14708",
"created_at": "2022-09-04T14:36:00.883846Z",
"updated_at": "2022-09-04T14:36:00.883861Z",
"structure_string": "Ge3 Pd6\n1.0\n3.388815 -5.869598 0.000000\n3.388815 5.869598 -0.000000\n0.000000 -0.000000 3.499901\nGe Pd\n3 6\ndirect\n0.666666 0.333332 0.000000 Ge\n0.333332 0.666666 0.000000 Ge\n0.000000 0.000000 0.500000 Ge\n-0.000000 0.391330 0.500000 Pd\n0.608669 0.608669 0.500000 Pd\n0.391330 -0.000000 0.500000 Pd\n0.730164 -0.000001 0.000000 Pd\n0.269836 0.269836 0.000000 Pd\n-0.000001 0.730164 0.000000 Pd\n",
"nsites": 9,
"nelements": 2,
"elements": [
"Ge",
"Pd"
],
"chemical_system": "Ge-Pd",
"density": 10.214193145836566,
"density_atomic": 0.06463987904089112,
"volume": 139.2329338102042,
"volume_molar": 9.316448064809032,
"formula_full": "Ge3 Pd6",
"formula_reduced": "GePd2",
"formula_anonymous": "AB2",
"energy_above_hull": 1.05944245,
"spacegroup": 189
},
{
"id": "jvasp-93450",
"created_at": "2022-09-04T14:35:48.764311Z",
"updated_at": "2022-09-04T14:35:48.764333Z",
"structure_string": "Cr2 Cl4\n1.0\n0.000000 0.000000 -3.592874\n0.000000 -5.808651 0.000000\n-6.190166 -0.000000 0.000000\nCr Cl\n2 4\ndirect\n0.499999 0.500000 0.500000 Cr\n0.000000 0.000000 0.000000 Cr\n0.499999 0.777155 0.164531 Cl\n0.499999 0.222845 0.835469 Cl\n0.000000 0.722845 0.664532 Cl\n0.000000 0.277155 0.335469 Cl\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Cr",
"Cl"
],
"chemical_system": "Cl-Cr",
"density": 3.1595034257030714,
"density_atomic": 0.046444221135020676,
"volume": 129.18722401560044,
"volume_molar": 12.966394123593306,
"formula_full": "Cr2 Cl4",
"formula_reduced": "CrCl2",
"formula_anonymous": "AB2",
"energy_above_hull": 1.1580518450000004,
"spacegroup": 58
}
]
}