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=1025",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=nelements&page=1023",
"results": [
{
"id": "jvasp-37611",
"created_at": "2022-09-04T14:37:47.740605Z",
"updated_at": "2022-09-04T14:37:47.740620Z",
"structure_string": "Tm1 Mg2\n1.0\n-1.874982 -0.000000 -2.643232\n0.000000 -5.173226 -0.000000\n-3.653369 2.586611 2.592923\nTm Mg\n1 2\ndirect\n0.666666 0.416667 0.666667 Tm\n0.166579 0.083333 0.000000 Mg\n0.166753 0.750000 0.333334 Mg\n",
"nsites": 3,
"nelements": 2,
"elements": [
"Tm",
"Mg"
],
"chemical_system": "Mg-Tm",
"density": 4.809687301271047,
"density_atomic": 0.03994307265155205,
"volume": 75.10689090373297,
"volume_molar": 15.076808968941453,
"formula_full": "Tm1 Mg2",
"formula_reduced": "TmMg2",
"formula_anonymous": "AB2",
"energy_above_hull": 0.3698872152777777,
"spacegroup": 191
},
{
"id": "jvasp-40380",
"created_at": "2022-09-04T14:37:49.693765Z",
"updated_at": "2022-09-04T14:37:49.693800Z",
"structure_string": "Tc6 Pt2\n1.0\n2.775663 -4.807590 -0.000000\n2.775663 4.807590 0.000000\n0.000000 -0.000000 4.389943\nTc Pt\n6 2\ndirect\n0.158032 0.316064 0.250000 Tc\n0.683934 0.841967 0.250000 Tc\n0.158031 0.841968 0.250000 Tc\n0.841967 0.683934 0.749999 Tc\n0.316064 0.158032 0.749999 Tc\n0.841968 0.158031 0.749999 Tc\n0.333332 0.666666 0.749999 Pt\n0.666666 0.333332 0.250000 Pt\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Tc",
"Pt"
],
"chemical_system": "Pt-Tc",
"density": 13.863711499191512,
"density_atomic": 0.06828211279290593,
"volume": 117.16099096498884,
"volume_molar": 8.81949973965314,
"formula_full": "Tc6 Pt2",
"formula_reduced": "Tc3Pt",
"formula_anonymous": "AB3",
"energy_above_hull": 4.675796475,
"spacegroup": 194
},
{
"id": "jvasp-4552",
"created_at": "2022-09-04T14:37:49.698739Z",
"updated_at": "2022-09-04T14:37:49.698760Z",
"structure_string": "Al1 Sn1\n1.0\n2.124593 -3.679903 0.000000\n2.124593 3.679903 0.000000\n0.000000 0.000000 3.269793\nAl Sn\n1 1\ndirect\n0.000000 0.000000 0.000000 Al\n0.333332 0.666666 0.500000 Sn\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Al",
"Sn"
],
"chemical_system": "Al-Sn",
"density": 4.731741977558497,
"density_atomic": 0.03911718760406497,
"volume": 51.1284200756847,
"volume_molar": 15.395127126609156,
"formula_full": "Al1 Sn1",
"formula_reduced": "AlSn",
"formula_anonymous": "AB",
"energy_above_hull": 0.7771072500000002,
"spacegroup": 187
},
{
"id": "jvasp-13886",
"created_at": "2022-09-04T14:37:57.049767Z",
"updated_at": "2022-09-04T14:37:57.049786Z",
"structure_string": "Ce2 S2\n1.0\n4.036876 -0.000000 -0.000000\n0.000000 4.036876 -0.000000\n0.000000 0.000000 5.687693\nCe S\n2 2\ndirect\n0.000000 0.500000 0.250035 Ce\n0.500000 0.000000 0.749964 Ce\n0.500000 0.000000 0.249961 S\n0.000000 0.500000 0.750039 S\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Ce",
"S"
],
"chemical_system": "Ce-S",
"density": 6.169320791279241,
"density_atomic": 0.04315518926190147,
"volume": 92.68873728544402,
"volume_molar": 13.954615569990105,
"formula_full": "Ce2 S2",
"formula_reduced": "CeS",
"formula_anonymous": "AB",
"energy_above_hull": 0.28651275,
"spacegroup": 225
},
{
"id": "jvasp-37727",
"created_at": "2022-09-04T14:37:57.090380Z",
"updated_at": "2022-09-04T14:37:57.090395Z",
"structure_string": "Tb1 Sc1\n1.0\n1.723214 -2.984695 -0.000000\n1.723214 2.984695 0.000000\n0.000000 -0.000000 5.353830\nTb Sc\n1 1\ndirect\n0.333331 0.666666 0.000000 Tb\n0.666666 0.333331 0.500000 Sc\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Tb",
"Sc"
],
"chemical_system": "Sc-Tb",
"density": 6.147416884879033,
"density_atomic": 0.036315853100748204,
"volume": 55.07236727859753,
"volume_molar": 16.582677386906624,
"formula_full": "Tb1 Sc1",
"formula_reduced": "TbSc",
"formula_anonymous": "AB",
"energy_above_hull": 1.369056825,
"spacegroup": 187
},
{
"id": "jvasp-41466",
"created_at": "2022-09-04T14:37:49.715567Z",
"updated_at": "2022-09-04T14:37:49.715596Z",
"structure_string": "U2 O4\n1.0\n5.128479 -0.000000 0.000000\n-0.000000 5.128479 0.000000\n0.000000 0.000000 3.600064\nU O\n2 4\ndirect\n0.000000 0.000000 0.000000 U\n0.500000 0.500000 0.499999 U\n0.308173 0.308173 0.000000 O\n0.691827 0.691827 0.000000 O\n0.191827 0.808174 0.499999 O\n0.808174 0.191827 0.499999 O\n",
"nsites": 6,
"nelements": 2,
"elements": [
"U",
"O"
],
"chemical_system": "O-U",
"density": 9.471091709833876,
"density_atomic": 0.06336710493215587,
"volume": 94.6863519553862,
"volume_molar": 9.503575658770616,
"formula_full": "U2 O4",
"formula_reduced": "UO2",
"formula_anonymous": "AB2",
"energy_above_hull": 2.065644333333333,
"spacegroup": 136
},
{
"id": "jvasp-34674",
"created_at": "2022-09-04T14:38:08.322090Z",
"updated_at": "2022-09-04T14:38:08.322116Z",
"structure_string": "Si4 O8\n1.0\n4.776527 0.000000 0.000000\n0.000000 5.838264 -0.709773\n0.000000 0.108275 5.880253\nSi O\n4 8\ndirect\n0.362714 0.034367 0.348877 Si\n0.862714 0.965632 0.651123 Si\n0.137287 0.651122 0.965632 Si\n0.637287 0.348877 0.034367 Si\n0.398575 0.479442 0.896724 O\n0.601425 0.896723 0.479443 O\n0.000000 0.733866 0.733867 O\n0.898576 0.520557 0.103276 O\n0.101425 0.103275 0.520557 O\n0.250000 0.872745 0.127255 O\n0.500000 0.266132 0.266132 O\n0.750001 0.127254 0.872745 O\n",
"nsites": 12,
"nelements": 2,
"elements": [
"Si",
"O"
],
"chemical_system": "O-Si",
"density": 2.4283261136947956,
"density_atomic": 0.07301602085523573,
"volume": 164.3474933233029,
"volume_molar": 8.247697819550751,
"formula_full": "Si4 O8",
"formula_reduced": "SiO2",
"formula_anonymous": "AB2",
"energy_above_hull": 1.3932185333333336,
"spacegroup": 20
},
{
"id": "jvasp-16494",
"created_at": "2022-09-04T14:38:02.310508Z",
"updated_at": "2022-09-04T14:38:02.310527Z",
"structure_string": "Zr4 P4\n1.0\n1.859371 -3.220526 -0.000000\n1.859371 3.220526 0.000000\n0.000000 0.000000 12.617549\nZr P\n4 4\ndirect\n0.333332 0.666667 0.384044 Zr\n0.666667 0.333332 0.884044 Zr\n0.666667 0.333332 0.615956 Zr\n0.333332 0.666667 0.115956 Zr\n0.666667 0.333332 0.250000 P\n0.333332 0.666667 0.750000 P\n0.000000 0.000000 0.500000 P\n0.000000 0.000000 0.000000 P\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Zr",
"P"
],
"chemical_system": "P-Zr",
"density": 5.3712390635545795,
"density_atomic": 0.05294099855530001,
"volume": 151.11161894015893,
"volume_molar": 11.375192996613988,
"formula_full": "Zr4 P4",
"formula_reduced": "ZrP",
"formula_anonymous": "AB",
"energy_above_hull": 1.7001399999999998,
"spacegroup": 194
},
{
"id": "jvasp-57274",
"created_at": "2022-09-04T14:38:03.460705Z",
"updated_at": "2022-09-04T14:38:03.460734Z",
"structure_string": "Ti2 F6\n1.0\n4.505727 -0.166103 3.177817\n1.557819 4.231120 3.177817\n-0.247767 -0.166103 5.508060\nTi F\n2 6\ndirect\n0.000000 0.000000 0.000000 Ti\n0.500000 0.500001 0.500000 Ti\n0.157085 0.342915 0.750000 F\n0.250000 0.842915 0.657086 F\n0.842915 0.657087 0.250000 F\n0.657085 0.250001 0.842914 F\n0.750000 0.157087 0.342914 F\n0.342914 0.750000 0.157086 F\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Ti",
"F"
],
"chemical_system": "F-Ti",
"density": 3.1247519243067354,
"density_atomic": 0.07178065770896752,
"volume": 111.45063663857408,
"volume_molar": 8.38964277036383,
"formula_full": "Ti2 F6",
"formula_reduced": "TiF3",
"formula_anonymous": "AB3",
"energy_above_hull": 0.0,
"spacegroup": 167
},
{
"id": "jvasp-20778",
"created_at": "2022-09-04T14:37:57.208162Z",
"updated_at": "2022-09-04T14:37:57.208183Z",
"structure_string": "Be2 O2\n1.0\n1.356277 -2.349142 0.000000\n1.356277 2.349142 0.000000\n0.000000 0.000000 4.406147\nBe O\n2 2\ndirect\n0.333334 0.666668 0.000074 Be\n0.666668 0.333334 0.500075 Be\n0.333334 0.666668 0.622426 O\n0.666668 0.333334 0.122426 O\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Be",
"O"
],
"chemical_system": "Be-O",
"density": 2.9585138770353407,
"density_atomic": 0.1424666941425551,
"volume": 28.07673768296692,
"volume_molar": 4.227051660210577,
"formula_full": "Be2 O2",
"formula_reduced": "BeO",
"formula_anonymous": "AB",
"energy_above_hull": 0.0,
"spacegroup": 186
},
{
"id": "jvasp-37964",
"created_at": "2022-09-04T14:37:49.717983Z",
"updated_at": "2022-09-04T14:37:49.718003Z",
"structure_string": "Ac1 Er3\n1.0\n5.089374 0.000000 0.000000\n-0.000000 5.089374 0.000000\n0.000000 0.000000 5.089374\nAc Er\n1 3\ndirect\n0.000000 0.000000 0.000000 Ac\n0.000000 0.500000 0.500000 Er\n0.500000 0.000000 0.500000 Er\n0.500000 0.500000 0.000000 Er\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Ac",
"Er"
],
"chemical_system": "Ac-Er",
"density": 9.180168550039125,
"density_atomic": 0.030343585062627274,
"volume": 131.82357957190123,
"volume_molar": 19.846503791726246,
"formula_full": "Ac1 Er3",
"formula_reduced": "AcEr3",
"formula_anonymous": "AB3",
"energy_above_hull": 1.22515,
"spacegroup": 221
},
{
"id": "jvasp-78370",
"created_at": "2022-09-04T14:37:57.269370Z",
"updated_at": "2022-09-04T14:37:57.269399Z",
"structure_string": "Rb1 S1\n1.0\n-3.352851 -3.352851 -0.000000\n-3.352851 0.000000 -3.352851\n-0.000000 -3.352851 -3.352851\nRb S\n1 1\ndirect\n0.000000 0.000000 0.000000 Rb\n0.500000 0.500000 0.500000 S\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Rb",
"S"
],
"chemical_system": "Rb-S",
"density": 2.5890201030536026,
"density_atomic": 0.026531221065858333,
"volume": 75.38288550818709,
"volume_molar": 22.69831737126334,
"formula_full": "Rb1 S1",
"formula_reduced": "RbS",
"formula_anonymous": "AB",
"energy_above_hull": 0.3510175,
"spacegroup": 225
}
]
}