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=587",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=volume&page=585",
"results": [
{
"id": "jvasp-123564",
"created_at": "2022-09-04T14:38:51.946995Z",
"updated_at": "2022-09-04T14:38:51.947008Z",
"structure_string": "Co1 P3\n1.0\n3.067861 -0.000000 -0.982367\n-0.211194 3.443156 -0.659542\n0.089068 -0.791320 5.559685\nCo P\n1 3\ndirect\n0.369487 0.854328 0.738973 Co\n0.588178 0.114670 0.176354 P\n0.143118 0.576285 0.286233 P\n0.899221 0.454720 0.798442 P\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Co",
"P"
],
"chemical_system": "Co-P",
"density": 4.403501330024443,
"density_atomic": 0.06985241312811476,
"volume": 57.26359077479098,
"volume_molar": 8.621235101720718,
"formula_full": "Co1 P3",
"formula_reduced": "CoP3",
"formula_anonymous": "AB3",
"energy_above_hull": 3.03259435,
"spacegroup": 8
},
{
"id": "jvasp-71918",
"created_at": "2022-09-04T14:36:18.293820Z",
"updated_at": "2022-09-04T14:36:18.293847Z",
"structure_string": "Ta1 Be1 Ga2\n1.0\n-1.821238 1.821238 4.316056\n1.821238 -1.821238 4.316056\n1.821238 1.821238 -4.316056\nTa Be Ga\n1 1 2\ndirect\n0.250000 0.750001 0.500001 Ta\n0.750001 0.250000 0.500001 Be\n0.000000 0.000000 0.000000 Ga\n0.500000 0.500000 0.000000 Ga\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ta",
"Be",
"Ga"
],
"chemical_system": "Be-Ga-Ta",
"density": 9.552129812485735,
"density_atomic": 0.06985210892501505,
"volume": 57.26384015540499,
"volume_molar": 8.621272646849729,
"formula_full": "Ta1 Be1 Ga2",
"formula_reduced": "TaBeGa2",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.9007124874999997,
"spacegroup": 139
},
{
"id": "jvasp-78854",
"created_at": "2022-09-04T14:36:36.708159Z",
"updated_at": "2022-09-04T14:36:36.708183Z",
"structure_string": "Zr1 As1 Ir1\n1.0\n3.746916 -0.000000 2.163283\n1.248972 3.532626 2.163283\n0.000000 -0.000000 4.326566\nZr As Ir\n1 1 1\ndirect\n0.500000 0.500001 0.500000 Zr\n0.250000 0.250000 0.250000 As\n0.000000 0.000000 0.000000 Ir\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Zr",
"As",
"Ir"
],
"chemical_system": "As-Ir-Zr",
"density": 10.390987567644006,
"density_atomic": 0.052384922245837434,
"volume": 57.2683869973365,
"volume_molar": 11.49594291987047,
"formula_full": "Zr1 As1 Ir1",
"formula_reduced": "ZrAsIr",
"formula_anonymous": "ABC",
"energy_above_hull": 3.196285783333333,
"spacegroup": 216
},
{
"id": "jvasp-71897",
"created_at": "2022-09-04T14:35:49.342706Z",
"updated_at": "2022-09-04T14:35:49.342731Z",
"structure_string": "Ti1 Be1 Ge2\n1.0\n-1.819843 1.819843 4.323035\n1.819843 -1.819843 4.323035\n1.819843 1.819843 -4.323035\nTi Be Ge\n1 1 2\ndirect\n0.499999 0.499999 0.000000 Ti\n0.749999 0.250000 0.499999 Be\n0.000000 0.000000 0.000000 Ge\n0.250000 0.749999 0.499999 Ge\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ti",
"Be",
"Ge"
],
"chemical_system": "Be-Ge-Ti",
"density": 5.861732304903054,
"density_atomic": 0.06984629973377003,
"volume": 57.26860285006676,
"volume_molar": 8.62198968729098,
"formula_full": "Ti1 Be1 Ge2",
"formula_reduced": "TiBeGe2",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.7778040833333335,
"spacegroup": 119
},
{
"id": "jvasp-77462",
"created_at": "2022-09-04T14:38:05.162918Z",
"updated_at": "2022-09-04T14:38:05.162943Z",
"structure_string": "Li2 Rh1 Au1\n1.0\n-10.363713 1.835365 -2.870753\n-7.257002 0.888875 0.366043\n-6.417982 3.348580 -1.094152\nLi Rh Au\n2 1 1\ndirect\n0.734801 0.013315 0.013342 Li\n0.265200 0.986686 0.986654 Li\n0.000002 0.999999 -0.000002 Rh\n0.500002 1.000000 -0.000003 Au\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Li",
"Rh",
"Au"
],
"chemical_system": "Au-Li-Rh",
"density": 9.095439745656924,
"density_atomic": 0.06983051230659683,
"volume": 57.281550254674606,
"volume_molar": 8.623938964616608,
"formula_full": "Li2 Rh1 Au1",
"formula_reduced": "Li2RhAu",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.0870576425000005,
"spacegroup": 12
},
{
"id": "jvasp-114474",
"created_at": "2022-09-04T14:38:41.194573Z",
"updated_at": "2022-09-04T14:38:41.194612Z",
"structure_string": "B3 Br1\n1.0\n5.809787 -0.083660 0.334647\n-0.491706 -3.570709 0.430866\n-0.210501 1.997979 -3.024219\nB Br\n3 1\ndirect\n0.921179 0.085131 0.883954 B\n0.921165 0.511741 0.457284 B\n0.104954 0.389816 0.761883 B\n0.367853 0.020577 0.392471 Br\n",
"nsites": 4,
"nelements": 2,
"elements": [
"B",
"Br"
],
"chemical_system": "B-Br",
"density": 3.256185942157583,
"density_atomic": 0.06982280136084355,
"volume": 57.28787619574355,
"volume_molar": 8.624891357305524,
"formula_full": "B3 Br1",
"formula_reduced": "B3Br",
"formula_anonymous": "AB3",
"energy_above_hull": 3.41938796375,
"spacegroup": 42
},
{
"id": "jvasp-35995",
"created_at": "2022-09-04T14:37:28.938894Z",
"updated_at": "2022-09-04T14:37:28.938915Z",
"structure_string": "Li2 Sn1 Ir1\n1.0\n3.059721 3.059721 -0.000000\n3.059721 0.000000 -3.059721\n-0.000000 3.059721 -3.059721\nLi Sn Ir\n2 1 1\ndirect\n0.250000 0.250000 0.250000 Li\n0.750000 0.750000 0.750000 Li\n0.500000 0.500000 0.500000 Sn\n0.000000 0.000000 0.000000 Ir\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Li",
"Sn",
"Ir"
],
"chemical_system": "Ir-Li-Sn",
"density": 9.414595701761286,
"density_atomic": 0.06982075069852177,
"volume": 57.289558762717334,
"volume_molar": 8.625144673684382,
"formula_full": "Li2 Sn1 Ir1",
"formula_reduced": "Li2SnIr",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.5352582,
"spacegroup": 225
},
{
"id": "jvasp-38319",
"created_at": "2022-09-04T14:35:55.329674Z",
"updated_at": "2022-09-04T14:35:55.329699Z",
"structure_string": "Rb1 Mn1 O3\n1.0\n3.855087 0.000000 0.000000\n-0.000000 3.855087 -0.000000\n0.000000 0.000000 3.855059\nRb Mn O\n1 1 3\ndirect\n0.000000 0.000000 0.000000 Rb\n0.500000 0.500000 0.500000 Mn\n0.000000 0.500000 0.500000 O\n0.500000 0.500000 0.000000 O\n0.500000 0.000000 0.500000 O\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Rb",
"Mn",
"O"
],
"chemical_system": "Mn-O-Rb",
"density": 5.460594460339997,
"density_atomic": 0.08727113179764233,
"volume": 57.29271406257937,
"volume_molar": 6.900495772145689,
"formula_full": "Rb1 Mn1 O3",
"formula_reduced": "RbMnO3",
"formula_anonymous": "ABC3",
"energy_above_hull": 1.9575335482758616,
"spacegroup": 221
},
{
"id": "jvasp-74893",
"created_at": "2022-09-04T14:35:52.281834Z",
"updated_at": "2022-09-04T14:35:52.281855Z",
"structure_string": "Be2 Cd1 Ga1\n1.0\n-1.904656 1.904656 3.948351\n1.904656 -1.904656 3.948351\n1.904656 1.904656 -3.948351\nBe Cd Ga\n2 1 1\ndirect\n0.000000 0.000000 0.000000 Be\n0.250000 0.750001 0.500001 Be\n0.500000 0.500000 0.000000 Cd\n0.750001 0.250000 0.500001 Ga\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Be",
"Cd",
"Ga"
],
"chemical_system": "Be-Cd-Ga",
"density": 5.801148687939903,
"density_atomic": 0.06981538674154295,
"volume": 57.293960353009695,
"volume_molar": 8.625807348592092,
"formula_full": "Be2 Cd1 Ga1",
"formula_reduced": "Be2CdGa",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.8604137296875,
"spacegroup": 119
},
{
"id": "jvasp-121186",
"created_at": "2022-09-04T14:38:54.258521Z",
"updated_at": "2022-09-04T14:38:54.258543Z",
"structure_string": "Li1 S2\n1.0\n4.463233 -0.000000 -0.000000\n-2.231617 3.865273 0.000000\n-0.000000 -0.000000 3.321347\nLi S\n1 2\ndirect\n0.000000 0.000000 0.000000 Li\n0.333333 0.666666 0.000000 S\n0.666666 0.333333 0.000000 S\n",
"nsites": 3,
"nelements": 2,
"elements": [
"Li",
"S"
],
"chemical_system": "Li-S",
"density": 2.0596695094946202,
"density_atomic": 0.05235730344110757,
"volume": 57.298596429330125,
"volume_molar": 11.502007101595316,
"formula_full": "Li1 S2",
"formula_reduced": "LiS2",
"formula_anonymous": "AB2",
"energy_above_hull": 1.32199,
"spacegroup": 191
},
{
"id": "jvasp-37714",
"created_at": "2022-09-04T14:38:01.205013Z",
"updated_at": "2022-09-04T14:38:01.205028Z",
"structure_string": "Na1 Cu3\n1.0\n-1.924327 1.924327 3.868527\n1.924327 -1.924327 3.868527\n1.924327 1.924327 -3.868527\nNa Cu\n1 3\ndirect\n0.000000 0.000000 0.000000 Na\n0.750002 0.250000 0.500002 Cu\n0.250000 0.750002 0.500002 Cu\n0.499999 0.499999 0.000000 Cu\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Na",
"Cu"
],
"chemical_system": "Cu-Na",
"density": 6.1907523690546835,
"density_atomic": 0.06980662170519573,
"volume": 57.30115427863885,
"volume_molar": 8.626890419410985,
"formula_full": "Na1 Cu3",
"formula_reduced": "NaCu3",
"formula_anonymous": "AB3",
"energy_above_hull": 0.0,
"spacegroup": 139
},
{
"id": "jvasp-117841",
"created_at": "2022-09-04T14:38:50.060689Z",
"updated_at": "2022-09-04T14:38:50.060714Z",
"structure_string": "P1 Br1\n1.0\n4.599413 -0.000000 -0.000000\n-2.299706 3.983208 0.000000\n-0.000000 -0.000000 3.127769\nP Br\n1 1\ndirect\n0.333333 0.666666 0.000000 P\n0.000000 0.000000 0.000000 Br\n",
"nsites": 2,
"nelements": 2,
"elements": [
"P",
"Br"
],
"chemical_system": "Br-P",
"density": 3.213094390979566,
"density_atomic": 0.034902772846970465,
"volume": 57.30203754208596,
"volume_molar": 17.254046795662305,
"formula_full": "P1 Br1",
"formula_reduced": "PBr",
"formula_anonymous": "AB",
"energy_above_hull": 1.3929598025,
"spacegroup": 187
}
]
}