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=nelements&page=84",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=nelements&page=82",
"results": [
{
"id": "jvasp-101097",
"created_at": "2022-09-04T14:36:33.812090Z",
"updated_at": "2022-09-04T14:36:33.812123Z",
"structure_string": "Ti3 Ni3\n1.0\n4.472468 -0.000000 0.000000\n-2.236233 3.873271 0.000000\n-0.000000 -0.000000 4.761796\nTi Ni\n3 3\ndirect\n0.000000 0.000000 0.725134 Ti\n0.333334 0.666666 0.147686 Ti\n0.666667 0.333333 0.147686 Ti\n0.000000 0.000000 0.213795 Ni\n0.666667 0.333333 0.652850 Ni\n0.333334 0.666666 0.652850 Ni\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Ti",
"Ni"
],
"chemical_system": "Ni-Ti",
"density": 6.4353219993673045,
"density_atomic": 0.07273699222132657,
"volume": 82.48897592222397,
"volume_molar": 8.279337069198059,
"formula_full": "Ti3 Ni3",
"formula_reduced": "TiNi",
"formula_anonymous": "AB",
"energy_above_hull": 1.537670366666667,
"spacegroup": 183
},
{
"id": "jvasp-19933",
"created_at": "2022-09-04T14:36:33.845671Z",
"updated_at": "2022-09-04T14:36:33.845701Z",
"structure_string": "Ca1 Ga2\n1.0\n2.143891 -3.713328 0.000000\n2.143891 3.713328 -0.000000\n0.000000 -0.000000 4.283956\nCa Ga\n1 2\ndirect\n0.000000 0.000000 0.000000 Ca\n0.666667 0.333333 0.500000 Ga\n0.333333 0.666667 0.500000 Ga\n",
"nsites": 3,
"nelements": 2,
"elements": [
"Ca",
"Ga"
],
"chemical_system": "Ca-Ga",
"density": 4.37049475107422,
"density_atomic": 0.043982533685032056,
"volume": 68.20889450079468,
"volume_molar": 13.692118792259185,
"formula_full": "Ca1 Ga2",
"formula_reduced": "CaGa2",
"formula_anonymous": "AB2",
"energy_above_hull": 0.01423,
"spacegroup": 191
},
{
"id": "jvasp-14269",
"created_at": "2022-09-04T14:36:33.866615Z",
"updated_at": "2022-09-04T14:36:33.866631Z",
"structure_string": "Yb2 Si2\n1.0\n3.876533 -0.000000 0.000000\n-0.000000 4.180944 -1.694275\n-0.000000 -0.097518 5.765127\nYb Si\n2 2\ndirect\n0.250000 0.860942 0.721886 Yb\n0.749999 0.139057 0.278113 Yb\n0.250000 0.570912 0.141825 Si\n0.749999 0.429086 0.858174 Si\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Yb",
"Si"
],
"chemical_system": "Si-Yb",
"density": 7.197914817890622,
"density_atomic": 0.04310428685254415,
"volume": 92.79819461307031,
"volume_molar": 13.971094755844577,
"formula_full": "Yb2 Si2",
"formula_reduced": "YbSi",
"formula_anonymous": "AB",
"energy_above_hull": 0.4857046499999997,
"spacegroup": 63
},
{
"id": "jvasp-49796",
"created_at": "2022-09-04T14:36:33.950646Z",
"updated_at": "2022-09-04T14:36:33.950668Z",
"structure_string": "Zr2 O4\n1.0\n0.000000 4.037513 0.000000\n2.018429 -2.018758 5.365141\n4.037545 0.000000 -0.000255\nZr O\n2 4\ndirect\n-0.000001 -0.000002 0.000040 Zr\n0.750000 0.500003 0.749959 Zr\n0.798172 0.596347 0.201797 O\n0.201827 0.403655 0.798043 O\n0.951826 0.903653 0.548203 O\n0.548173 0.096346 0.951955 O\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Zr",
"O"
],
"chemical_system": "O-Zr",
"density": 4.678939156622646,
"density_atomic": 0.06860068968988216,
"volume": 87.46267752006192,
"volume_molar": 8.778542587871677,
"formula_full": "Zr2 O4",
"formula_reduced": "ZrO2",
"formula_anonymous": "AB2",
"energy_above_hull": 1.4872538333333345,
"spacegroup": 141
},
{
"id": "jvasp-100827",
"created_at": "2022-09-04T14:36:34.624041Z",
"updated_at": "2022-09-04T14:36:34.624062Z",
"structure_string": "La1 Hg3\n1.0\n3.839998 -0.000000 0.000000\n-1.919999 3.325536 0.000000\n-0.000000 0.000000 9.040968\nLa Hg\n1 3\ndirect\n0.000000 -0.000000 0.500000 La\n0.000000 0.000000 0.000000 Hg\n0.333334 0.666667 0.765310 Hg\n0.333334 0.666667 0.234690 Hg\n",
"nsites": 4,
"nelements": 2,
"elements": [
"La",
"Hg"
],
"chemical_system": "Hg-La",
"density": 10.652939862717076,
"density_atomic": 0.03464594467170211,
"volume": 115.4536277738472,
"volume_molar": 17.381949942668832,
"formula_full": "La1 Hg3",
"formula_reduced": "LaHg3",
"formula_anonymous": "AB3",
"energy_above_hull": 0.0,
"spacegroup": 187
},
{
"id": "jvasp-78560",
"created_at": "2022-09-04T14:36:34.657418Z",
"updated_at": "2022-09-04T14:36:34.657438Z",
"structure_string": "Mg1 Zr1\n1.0\n3.051484 0.000000 0.000000\n-1.525742 2.642662 -0.000000\n0.000000 -0.000000 5.501298\nMg Zr\n1 1\ndirect\n0.333333 0.666667 0.000000 Mg\n0.000000 0.000000 0.500000 Zr\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Mg",
"Zr"
],
"chemical_system": "Mg-Zr",
"density": 4.324363806233439,
"density_atomic": 0.045082927312772844,
"volume": 44.362691582215916,
"volume_molar": 13.357918660028568,
"formula_full": "Mg1 Zr1",
"formula_reduced": "MgZr",
"formula_anonymous": "AB",
"energy_above_hull": 1.3144347857142862,
"spacegroup": 187
},
{
"id": "jvasp-99328",
"created_at": "2022-09-04T14:36:34.748405Z",
"updated_at": "2022-09-04T14:36:34.748431Z",
"structure_string": "V16 O24\n1.0\n7.672116 -0.000000 -2.712503\n-3.836058 6.644247 -2.712503\n0.000000 0.000000 8.137508\nV O\n16 24\ndirect\n0.000000 0.000000 0.000000 V\n0.250000 0.033920 0.783920 V\n0.716080 0.750000 0.466081 V\n0.466080 0.716080 0.750001 V\n0.783920 0.250000 0.033920 V\n0.033920 0.783920 0.250000 V\n0.750000 0.966080 0.216081 V\n0.750000 0.466080 0.716081 V\n0.533920 0.283920 0.250000 V\n0.216080 0.750000 0.966081 V\n0.966081 0.216080 0.750001 V\n0.250000 0.533920 0.283920 V\n0.500000 0.500000 0.000000 V\n0.500000 0.000000 0.500000 V\n0.283920 0.250000 0.533920 V\n-0.000000 0.500000 0.500000 V\n0.226379 0.274174 0.763469 O\n0.273621 0.037089 0.047795 O\n0.010705 0.462911 0.736532 O\n0.452206 0.489295 0.225826 O\n0.537090 0.263469 0.989295 O\n0.763469 0.226379 0.274175 O\n0.774174 0.547795 0.510706 O\n0.725826 0.236531 0.773621 O\n0.952206 0.726380 0.962912 O\n0.726380 0.962911 0.952206 O\n0.989295 0.537090 0.263470 O\n0.547795 0.510705 0.774175 O\n0.773621 0.725826 0.236532 O\n0.489295 0.225826 0.452206 O\n0.263469 0.989295 0.537090 O\n0.236531 0.773621 0.725827 O\n0.962911 0.952206 0.726380 O\n0.462911 0.736531 0.010706 O\n0.225826 0.452205 0.489295 O\n0.274174 0.763469 0.226380 O\n0.047795 0.273621 0.037090 O\n0.037089 0.047795 0.273621 O\n0.510705 0.774174 0.547795 O\n0.736532 0.010705 0.462911 O\n",
"nsites": 40,
"nelements": 2,
"elements": [
"V",
"O"
],
"chemical_system": "O-V",
"density": 4.799918771017288,
"density_atomic": 0.09642899338149663,
"volume": 414.81299967272537,
"volume_molar": 6.245155682767465,
"formula_full": "V16 O24",
"formula_reduced": "V2O3",
"formula_anonymous": "A2B3",
"energy_above_hull": 2.9124797799999995,
"spacegroup": 206
},
{
"id": "jvasp-96930",
"created_at": "2022-09-04T14:35:47.441271Z",
"updated_at": "2022-09-04T14:35:47.441298Z",
"structure_string": "Dy20 Si16\n1.0\n7.416217 -0.000000 0.000000\n-0.000000 7.703509 0.000000\n0.000000 0.000000 14.565951\nDy Si\n20 16\ndirect\n0.650748 0.988242 0.750000 Dy\n0.680301 0.820814 0.376971 Dy\n0.180301 0.679186 0.123029 Dy\n0.319700 0.179186 0.876971 Dy\n0.319700 0.179186 0.623029 Dy\n0.819700 0.320814 0.876971 Dy\n0.180301 0.679186 0.376971 Dy\n0.680301 0.820814 0.123029 Dy\n0.974398 0.817240 0.597774 Dy\n0.474398 0.682760 0.902226 Dy\n0.819700 0.320814 0.623029 Dy\n0.025602 0.182760 0.097774 Dy\n0.025602 0.182760 0.402226 Dy\n0.525602 0.317240 0.097774 Dy\n0.474398 0.682760 0.597774 Dy\n0.974398 0.817240 0.902226 Dy\n0.349253 0.011758 0.250000 Dy\n0.849253 0.488242 0.250000 Dy\n0.150747 0.511758 0.750000 Dy\n0.525602 0.317240 0.402226 Dy\n0.650243 0.029017 0.539772 Si\n0.150243 0.470983 0.960228 Si\n0.150243 0.470983 0.539772 Si\n0.650243 0.029017 0.960228 Si\n0.349757 0.970983 0.460228 Si\n0.849758 0.529018 0.039772 Si\n0.976766 0.896191 0.250000 Si\n0.230826 0.371325 0.250000 Si\n0.523234 0.396191 0.750000 Si\n0.023234 0.103809 0.750000 Si\n0.730826 0.128675 0.250000 Si\n0.269174 0.871325 0.750000 Si\n0.769174 0.628675 0.750000 Si\n0.349757 0.970983 0.039772 Si\n0.476766 0.603809 0.250000 Si\n0.849758 0.529018 0.460228 Si\n",
"nsites": 36,
"nelements": 2,
"elements": [
"Dy",
"Si"
],
"chemical_system": "Dy-Si",
"density": 7.3818763316318305,
"density_atomic": 0.043260609403147486,
"volume": 832.1658084960026,
"volume_molar": 13.920610095617032,
"formula_full": "Dy20 Si16",
"formula_reduced": "Dy5Si4",
"formula_anonymous": "A4B5",
"energy_above_hull": 2.491180766666666,
"spacegroup": 62
},
{
"id": "jvasp-19910",
"created_at": "2022-09-04T14:36:34.851886Z",
"updated_at": "2022-09-04T14:36:34.851917Z",
"structure_string": "Co2 Pt2\n1.0\n3.710175 -0.000000 0.000000\n0.000000 3.814975 0.000000\n0.000000 0.000000 3.814975\nCo Pt\n2 2\ndirect\n0.000000 0.000000 0.000000 Co\n0.000000 0.500001 0.500001 Co\n0.500001 0.000000 0.500001 Pt\n0.500001 0.500001 0.000000 Pt\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Co",
"Pt"
],
"chemical_system": "Co-Pt",
"density": 15.622999604541564,
"density_atomic": 0.07407679841869526,
"volume": 53.998014025812616,
"volume_molar": 8.129591030597446,
"formula_full": "Co2 Pt2",
"formula_reduced": "CoPt",
"formula_anonymous": "AB",
"energy_above_hull": 1.93170615,
"spacegroup": 123
},
{
"id": "jvasp-14674",
"created_at": "2022-09-04T14:36:34.849539Z",
"updated_at": "2022-09-04T14:36:34.849580Z",
"structure_string": "Sm1 Pd3\n1.0\n4.160017 0.000000 -0.000000\n0.000000 4.160017 0.000000\n-0.000000 -0.000000 4.160017\nSm Pd\n1 3\ndirect\n0.000000 0.000000 0.000000 Sm\n0.000000 0.500000 0.500000 Pd\n0.500000 0.500000 0.000000 Pd\n0.500000 0.000000 0.500000 Pd\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Sm",
"Pd"
],
"chemical_system": "Pd-Sm",
"density": 10.832042754344501,
"density_atomic": 0.05556159125040969,
"volume": 71.99217858920672,
"volume_molar": 10.838675827081527,
"formula_full": "Sm1 Pd3",
"formula_reduced": "SmPd3",
"formula_anonymous": "AB3",
"energy_above_hull": 1.4136164937500002,
"spacegroup": 221
},
{
"id": "jvasp-99624",
"created_at": "2022-09-04T14:36:34.902598Z",
"updated_at": "2022-09-04T14:36:34.902626Z",
"structure_string": "Co4 H1\n1.0\n2.526100 -0.000000 0.000000\n-1.263050 2.187667 0.000000\n-0.000000 -0.000000 8.153047\nCo H\n4 1\ndirect\n0.333334 0.666668 0.864726 Co\n0.333334 0.666668 0.377941 Co\n0.666667 0.333334 0.135274 Co\n0.666667 0.333334 0.622059 Co\n0.000000 0.000000 0.000000 H\n",
"nsites": 5,
"nelements": 2,
"elements": [
"Co",
"H"
],
"chemical_system": "Co-H",
"density": 8.725098953219618,
"density_atomic": 0.11097324967875236,
"volume": 45.055903242214704,
"volume_molar": 5.426659827871147,
"formula_full": "Co4 H1",
"formula_reduced": "Co4H",
"formula_anonymous": "AB4",
"energy_above_hull": 3.35193872,
"spacegroup": 164
},
{
"id": "jvasp-100283",
"created_at": "2022-09-04T14:36:35.017390Z",
"updated_at": "2022-09-04T14:36:35.017401Z",
"structure_string": "Nd1 In1\n1.0\n3.861320 0.000000 -0.000000\n-0.000000 3.861320 0.000000\n0.000000 0.000000 3.861320\nNd In\n1 1\ndirect\n0.000000 0.000000 0.000000 Nd\n0.500000 0.500000 0.500000 In\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Nd",
"In"
],
"chemical_system": "In-Nd",
"density": 7.47208967164819,
"density_atomic": 0.03473942390917773,
"volume": 57.57147859529197,
"volume_molar": 17.335177393108765,
"formula_full": "Nd1 In1",
"formula_reduced": "NdIn",
"formula_anonymous": "AB",
"energy_above_hull": 0.1775838333333332,
"spacegroup": 221
}
]
}