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=3876",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=nelements&page=3874",
"results": [
{
"id": "jvasp-41845",
"created_at": "2022-09-04T14:37:35.801858Z",
"updated_at": "2022-09-04T14:37:35.801876Z",
"structure_string": "Be1 Ga1 Rh2\n1.0\n0.000000 2.919550 2.919550\n2.919550 0.000000 2.919550\n2.919550 2.919550 0.000000\nBe Ga Rh\n1 1 2\ndirect\n0.250001 0.250001 0.250001 Be\n0.750000 0.750000 0.750000 Ga\n0.000000 0.000000 0.000000 Rh\n0.499999 0.499999 0.499999 Rh\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Be",
"Ga",
"Rh"
],
"chemical_system": "Be-Ga-Rh",
"density": 9.493450984649739,
"density_atomic": 0.08036783027013641,
"volume": 49.77115826761775,
"volume_molar": 7.493223021895796,
"formula_full": "Be1 Ga1 Rh2",
"formula_reduced": "BeGaRh2",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.6351411062500003,
"spacegroup": 225
},
{
"id": "jvasp-46445",
"created_at": "2022-09-04T14:38:01.930648Z",
"updated_at": "2022-09-04T14:38:01.930674Z",
"structure_string": "Mn3 Cr1 O8\n1.0\n0.013518 4.060000 4.060000\n4.060000 0.013518 4.060000\n4.060000 4.060000 0.013518\nMn Cr O\n3 1 8\ndirect\n0.000000 0.500000 0.500000 Mn\n0.500000 0.000000 0.500000 Mn\n0.500000 0.500000 0.000000 Mn\n0.500000 0.500000 0.500000 Cr\n0.264082 0.264082 0.264082 O\n0.707497 0.263625 0.263625 O\n0.263625 0.707497 0.263625 O\n0.263625 0.263625 0.707497 O\n0.736375 0.736375 0.292504 O\n0.736375 0.292504 0.736375 O\n0.735919 0.735919 0.735919 O\n0.292504 0.736375 0.736375 O\n",
"nsites": 12,
"nelements": 3,
"elements": [
"Mn",
"Cr",
"O"
],
"chemical_system": "Cr-Mn-O",
"density": 4.2992187424617,
"density_atomic": 0.09010472970328351,
"volume": 133.1783585558296,
"volume_molar": 6.683490178407967,
"formula_full": "Mn3 Cr1 O8",
"formula_reduced": "Mn3CrO8",
"formula_anonymous": "AB3C8",
"energy_above_hull": 3.5939180936781616,
"spacegroup": 166
},
{
"id": "jvasp-40054",
"created_at": "2022-09-04T14:37:53.957139Z",
"updated_at": "2022-09-04T14:37:53.957164Z",
"structure_string": "Li2 Pd1 Au1\n1.0\n0.000000 3.021797 3.021797\n3.021797 -0.000000 3.021797\n3.021797 3.021797 -0.000000\nLi Pd Au\n2 1 1\ndirect\n0.500003 0.500003 0.500003 Li\n0.000000 0.000000 0.000000 Li\n0.750001 0.750001 0.750001 Pd\n0.250000 0.250000 0.250000 Au\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Li",
"Pd",
"Au"
],
"chemical_system": "Au-Li-Pd",
"density": 9.546634475169936,
"density_atomic": 0.07248266261586069,
"volume": 55.18561067767285,
"volume_molar": 8.308387885687623,
"formula_full": "Li2 Pd1 Au1",
"formula_reduced": "Li2PdAu",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.7305858175000001,
"spacegroup": 225
},
{
"id": "jvasp-109198",
"created_at": "2022-09-04T14:38:01.942578Z",
"updated_at": "2022-09-04T14:38:01.942605Z",
"structure_string": "Ce1 Co3 Cu2\n1.0\n4.953004 -0.000000 0.000000\n-2.476502 4.289427 0.000000\n0.000000 0.000000 4.005814\nCe Co Cu\n1 3 2\ndirect\n0.000000 0.000000 0.000000 Ce\n0.500000 0.500000 0.500000 Co\n0.500000 0.000000 0.500000 Co\n0.000000 0.500000 0.500000 Co\n0.666666 0.333334 -0.000000 Cu\n0.333334 0.666667 -0.000000 Cu\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Ce",
"Co",
"Cu"
],
"chemical_system": "Ce-Co-Cu",
"density": 8.663247996526504,
"density_atomic": 0.0705005508749134,
"volume": 85.10571797723375,
"volume_molar": 8.541976885662736,
"formula_full": "Ce1 Co3 Cu2",
"formula_reduced": "CeCo3Cu2",
"formula_anonymous": "AB2C3",
"energy_above_hull": 2.0479298500000005,
"spacegroup": 191
},
{
"id": "jvasp-35016",
"created_at": "2022-09-04T14:37:35.471293Z",
"updated_at": "2022-09-04T14:37:35.471312Z",
"structure_string": "Np2 Sb2 Te2\n1.0\n4.322385 0.000000 0.000000\n0.000000 4.322385 0.000000\n0.000000 -0.000000 9.049775\nNp Sb Te\n2 2 2\ndirect\n0.499999 0.000000 0.725824 Np\n0.000000 0.499999 0.274176 Np\n0.499999 0.499999 0.000000 Sb\n0.000000 0.000000 0.000000 Sb\n0.499999 0.000000 0.366964 Te\n0.000000 0.499999 0.633036 Te\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Np",
"Sb",
"Te"
],
"chemical_system": "Np-Sb-Te",
"density": 9.55327471239637,
"density_atomic": 0.03548677834744695,
"volume": 169.0770557207164,
"volume_molar": 16.97009714727529,
"formula_full": "Np2 Sb2 Te2",
"formula_reduced": "NpSbTe",
"formula_anonymous": "ABC",
"energy_above_hull": 2.6448379555555563,
"spacegroup": 129
},
{
"id": "jvasp-37228",
"created_at": "2022-09-04T14:37:54.258063Z",
"updated_at": "2022-09-04T14:37:54.258090Z",
"structure_string": "Sm1 Er1 Mg2\n1.0\n-0.000000 3.776224 3.776224\n3.776224 -0.000000 3.776224\n3.776224 3.776224 -0.000000\nSm Er Mg\n1 1 2\ndirect\n0.749999 0.749999 0.749999 Sm\n0.250000 0.250000 0.250000 Er\n0.000000 0.000000 0.000000 Mg\n0.499999 0.499999 0.499999 Mg\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Sm",
"Er",
"Mg"
],
"chemical_system": "Er-Mg-Sm",
"density": 5.6467503654696625,
"density_atomic": 0.037141270133377015,
"volume": 107.69690927735394,
"volume_molar": 16.214148677129383,
"formula_full": "Sm1 Er1 Mg2",
"formula_reduced": "SmErMg2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.2789767437499999,
"spacegroup": 225
},
{
"id": "jvasp-24958",
"created_at": "2022-09-04T14:37:53.150112Z",
"updated_at": "2022-09-04T14:37:53.150124Z",
"structure_string": "Rb2 Mn1 F6\n1.0\n5.178554 0.000000 2.989840\n1.726185 4.882388 2.989840\n0.000000 0.000000 5.979680\nRb Mn F\n2 1 6\ndirect\n0.749999 0.750000 0.750001 Rb\n0.250000 0.250000 0.250000 Rb\n0.000000 0.000000 0.000000 Mn\n0.216863 0.783136 0.783136 F\n0.216863 0.783136 0.216864 F\n0.783135 0.216864 0.783136 F\n0.783135 0.216864 0.216864 F\n0.783135 0.783136 0.216865 F\n0.216864 0.216864 0.783136 F\n",
"nsites": 9,
"nelements": 3,
"elements": [
"Rb",
"Mn",
"F"
],
"chemical_system": "F-Mn-Rb",
"density": 3.7328075655934962,
"density_atomic": 0.05952833932475776,
"volume": 151.18849445640274,
"volume_molar": 10.116426610099298,
"formula_full": "Rb2 Mn1 F6",
"formula_reduced": "Rb2MnF6",
"formula_anonymous": "AB2C6",
"energy_above_hull": 0.0541810507918261,
"spacegroup": 225
},
{
"id": "jvasp-16649",
"created_at": "2022-09-04T14:37:53.182330Z",
"updated_at": "2022-09-04T14:37:53.182345Z",
"structure_string": "Lu6 Sb2 Mo1\n1.0\n3.973235 -6.881844 0.000000\n3.973235 6.881844 -0.000000\n-0.000000 -0.000000 4.261375\nLu Sb Mo\n6 2 1\ndirect\n0.608339 -0.000000 0.500001 Lu\n0.391660 0.391660 0.500001 Lu\n-0.000000 0.608339 0.500001 Lu\n-0.000000 0.238741 0.000000 Lu\n0.761257 0.761257 0.000000 Lu\n0.238741 -0.000000 0.000000 Lu\n0.666666 0.333332 0.000000 Sb\n0.333332 0.666666 0.000000 Sb\n0.000000 0.000000 0.500001 Mo\n",
"nsites": 9,
"nelements": 3,
"elements": [
"Lu",
"Sb",
"Mo"
],
"chemical_system": "Lu-Mo-Sb",
"density": 9.899298698534837,
"density_atomic": 0.038620125784493434,
"volume": 233.03911670877147,
"volume_molar": 15.59327070451433,
"formula_full": "Lu6 Sb2 Mo1",
"formula_reduced": "Lu6Sb2Mo",
"formula_anonymous": "AB2C6",
"energy_above_hull": 2.2059547333333334,
"spacegroup": 189
},
{
"id": "jvasp-39851",
"created_at": "2022-09-04T14:37:53.204118Z",
"updated_at": "2022-09-04T14:37:53.204135Z",
"structure_string": "Ac1 Ti1 O3\n1.0\n4.008320 -0.000000 0.000000\n0.000000 4.008320 -0.000000\n-0.000000 0.000000 4.008320\nAc Ti O\n1 1 3\ndirect\n0.000000 0.000000 0.000000 Ac\n0.500000 0.500000 0.500000 Ti\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": [
"Ac",
"Ti",
"O"
],
"chemical_system": "Ac-O-Ti",
"density": 8.324979592191687,
"density_atomic": 0.07763952099147113,
"volume": 64.40019124473038,
"volume_molar": 7.756540332933719,
"formula_full": "Ac1 Ti1 O3",
"formula_reduced": "AcTiO3",
"formula_anonymous": "ABC3",
"energy_above_hull": 1.8178017666666668,
"spacegroup": 221
},
{
"id": "jvasp-17414",
"created_at": "2022-09-04T14:37:35.791539Z",
"updated_at": "2022-09-04T14:37:35.791569Z",
"structure_string": "Ti1 Al1 Au2\n1.0\n3.951106 -0.000000 2.281172\n1.317036 3.725139 2.281172\n0.000000 0.000000 4.562345\nTi Al Au\n1 1 2\ndirect\n0.500001 0.500000 0.499998 Ti\n0.000000 0.000000 0.000000 Al\n0.250000 0.250000 0.249999 Au\n0.750001 0.750000 0.749998 Au\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ti",
"Al",
"Au"
],
"chemical_system": "Al-Au-Ti",
"density": 11.592322068219284,
"density_atomic": 0.05956768256005329,
"volume": 67.15050557770803,
"volume_molar": 10.109744917353071,
"formula_full": "Ti1 Al1 Au2",
"formula_reduced": "TiAlAu2",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.4756790683333336,
"spacegroup": 225
},
{
"id": "jvasp-35535",
"created_at": "2022-09-04T14:37:53.773444Z",
"updated_at": "2022-09-04T14:37:53.773470Z",
"structure_string": "Ag1 P1 Pt5\n1.0\n3.954939 0.000000 0.000000\n0.000000 3.954939 0.000000\n0.000000 0.000000 7.135291\nAg P Pt\n1 1 5\ndirect\n0.500000 0.500000 0.000000 Ag\n0.000000 0.000000 0.500000 P\n0.000000 0.500000 0.296273 Pt\n0.000000 0.500000 0.703727 Pt\n0.500000 0.000000 0.296273 Pt\n0.500000 0.000000 0.703727 Pt\n0.000000 0.000000 0.000000 Pt\n",
"nsites": 7,
"nelements": 3,
"elements": [
"Ag",
"P",
"Pt"
],
"chemical_system": "Ag-P-Pt",
"density": 16.578496195372395,
"density_atomic": 0.06272010423210628,
"volume": 111.606957381565,
"volume_molar": 9.601611530672935,
"formula_full": "Ag1 P1 Pt5",
"formula_reduced": "AgPPt5",
"formula_anonymous": "ABC5",
"energy_above_hull": 2.557688537142857,
"spacegroup": 123
},
{
"id": "jvasp-110305",
"created_at": "2022-09-04T14:37:53.818806Z",
"updated_at": "2022-09-04T14:37:53.818827Z",
"structure_string": "Na2 Ge2 N2\n1.0\n3.104866 0.000000 0.000000\n-1.552434 2.688878 0.000000\n0.000000 -0.000000 10.374152\nNa Ge N\n2 2 2\ndirect\n0.666668 0.333333 0.753081 Na\n0.333335 0.666667 0.253081 Na\n1.000001 0.999996 0.500313 Ge\n0.000002 0.000005 0.000313 Ge\n0.333333 0.666663 0.591246 N\n0.666670 0.333338 0.091246 N\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Na",
"Ge",
"N"
],
"chemical_system": "Ge-N-Na",
"density": 4.204047050846924,
"density_atomic": 0.06927629996717875,
"volume": 86.60970639082397,
"volume_molar": 8.692930717796893,
"formula_full": "Na2 Ge2 N2",
"formula_reduced": "NaGeN",
"formula_anonymous": "ABC",
"energy_above_hull": 1.4619327333333332,
"spacegroup": 186
}
]
}