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=energy_above_hull&page=687",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=energy_above_hull&page=685",
"results": [
{
"id": "jvasp-25267",
"created_at": "2022-09-04T14:37:48.395142Z",
"updated_at": "2022-09-04T14:37:48.395159Z",
"structure_string": "P4\n1.0\n2.468968 0.181194 0.000000\n-0.181088 2.468975 0.000000\n0.000000 0.000000 9.906699\nP\n4\ndirect\n0.000001 0.000001 0.500000 P\n-0.000001 -0.000001 0.000000 P\n0.000000 0.000000 0.750000 P\n0.000000 0.000000 0.250000 P\n",
"nsites": 4,
"nelements": 1,
"elements": [
"P"
],
"chemical_system": "P",
"density": 3.3885235654316403,
"density_atomic": 0.0658821033320342,
"volume": 60.71451574399051,
"volume_molar": 9.140783999638673,
"formula_full": "P4",
"formula_reduced": "P",
"formula_anonymous": "A",
"energy_above_hull": 0.15408,
"spacegroup": 221
},
{
"id": "jvasp-99567",
"created_at": "2022-09-04T14:36:09.505492Z",
"updated_at": "2022-09-04T14:36:09.505526Z",
"structure_string": "K2 Cu1 Mo1 I6\n1.0\n6.919739 -0.000000 3.995113\n2.306580 6.523992 3.995113\n-0.000000 -0.000000 7.990226\nK Cu Mo I\n2 1 1 6\ndirect\n0.750000 0.750000 0.750000 K\n0.250000 0.250000 0.250000 K\n0.000000 0.000000 0.000000 Cu\n0.500000 0.500000 0.500000 Mo\n0.748982 0.748981 0.251018 I\n0.748982 0.251019 0.251018 I\n0.251019 0.251019 0.748982 I\n0.748982 0.251019 0.748981 I\n0.251019 0.748981 0.251018 I\n0.251019 0.748981 0.748981 I\n",
"nsites": 10,
"nelements": 4,
"elements": [
"K",
"Cu",
"Mo",
"I"
],
"chemical_system": "Cu-I-K-Mo",
"density": 4.5993870073404475,
"density_atomic": 0.02772284538913788,
"volume": 360.7133344226676,
"volume_molar": 21.722664739022576,
"formula_full": "K2 Cu1 Mo1 I6",
"formula_reduced": "K2CuMoI6",
"formula_anonymous": "ABC2D6",
"energy_above_hull": 0.154129,
"spacegroup": 225
},
{
"id": "jvasp-100962",
"created_at": "2022-09-04T14:36:41.387944Z",
"updated_at": "2022-09-04T14:36:41.387962Z",
"structure_string": "Dy1 Mg2\n1.0\n5.184614 -0.000000 0.000000\n-2.592307 4.490007 0.000000\n-0.000000 -0.000000 3.265608\nDy Mg\n1 2\ndirect\n0.000000 0.000000 0.000000 Dy\n0.333333 0.666667 0.500000 Mg\n0.666666 0.333334 0.500000 Mg\n",
"nsites": 3,
"nelements": 2,
"elements": [
"Dy",
"Mg"
],
"chemical_system": "Dy-Mg",
"density": 4.611374626563948,
"density_atomic": 0.039463332539231726,
"volume": 76.01993564576956,
"volume_molar": 15.26009176749886,
"formula_full": "Dy1 Mg2",
"formula_reduced": "DyMg2",
"formula_anonymous": "AB2",
"energy_above_hull": 0.154397388888889,
"spacegroup": 191
},
{
"id": "jvasp-114321",
"created_at": "2022-09-04T14:38:41.370512Z",
"updated_at": "2022-09-04T14:38:41.370537Z",
"structure_string": "K1 Zn1\n1.0\n3.689417 0.000000 -0.000000\n-0.000000 3.689417 0.000000\n-0.000000 0.000000 6.696483\nK Zn\n1 1\ndirect\n0.000000 0.000000 0.749955 K\n0.000000 0.000000 0.250045 Zn\n",
"nsites": 2,
"nelements": 2,
"elements": [
"K",
"Zn"
],
"chemical_system": "K-Zn",
"density": 1.9038532309442489,
"density_atomic": 0.02194157182721055,
"volume": 91.1511725663941,
"volume_molar": 27.446259581693784,
"formula_full": "K1 Zn1",
"formula_reduced": "KZn",
"formula_anonymous": "AB",
"energy_above_hull": 0.1544199999999999,
"spacegroup": 123
},
{
"id": "jvasp-115690",
"created_at": "2022-09-04T14:38:45.635156Z",
"updated_at": "2022-09-04T14:38:45.635172Z",
"structure_string": "In1 Se1 Br2\n1.0\n4.391705 0.000000 0.000000\n0.000000 4.391705 0.000000\n0.000000 -0.000000 6.253056\nIn Se Br\n1 1 2\ndirect\n0.499999 0.499999 0.502595 In\n0.000000 0.000000 0.002461 Se\n0.000000 0.000000 0.502387 Br\n0.499999 0.499999 0.002559 Br\n",
"nsites": 4,
"nelements": 3,
"elements": [
"In",
"Se",
"Br"
],
"chemical_system": "Br-In-Se",
"density": 4.8683917810513995,
"density_atomic": 0.033166630568461815,
"volume": 120.6031463384045,
"volume_molar": 18.157228083718763,
"formula_full": "In1 Se1 Br2",
"formula_reduced": "InSeBr2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.1544403866666666,
"spacegroup": 123
},
{
"id": "jvasp-25186",
"created_at": "2022-09-04T14:38:29.122815Z",
"updated_at": "2022-09-04T14:38:29.122832Z",
"structure_string": "P2\n1.0\n3.299155 -1.226702 4.273387\n-1.599475 1.084281 1.546012\n-1.716349 -1.684283 -0.594360\nP\n2\ndirect\n0.251905 0.985029 0.752867 P\n0.752219 0.985022 0.253217 P\n",
"nsites": 2,
"nelements": 1,
"elements": [
"P"
],
"chemical_system": "P",
"density": 3.3892240401444167,
"density_atomic": 0.06589572246335126,
"volume": 30.350983724509966,
"volume_molar": 9.138894809673404,
"formula_full": "P2",
"formula_reduced": "P",
"formula_anonymous": "A",
"energy_above_hull": 0.1544599999999998,
"spacegroup": 221
},
{
"id": "jvasp-79580",
"created_at": "2022-09-04T14:36:44.969859Z",
"updated_at": "2022-09-04T14:36:44.969878Z",
"structure_string": "Rb2 S2\n1.0\n4.818839 0.000000 -1.196506\n0.000000 4.851676 0.000000\n-1.132782 0.000000 5.746799\nRb S\n2 2\ndirect\n0.147542 0.250000 0.795022 Rb\n0.852459 0.750001 0.204978 Rb\n0.464351 0.250000 0.428793 S\n0.535650 0.750001 0.571206 S\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Rb",
"S"
],
"chemical_system": "Rb-S",
"density": 3.0547208443085716,
"density_atomic": 0.03130353214300946,
"volume": 127.7811073116635,
"volume_molar": 19.23789536748757,
"formula_full": "Rb2 S2",
"formula_reduced": "RbS",
"formula_anonymous": "AB",
"energy_above_hull": 0.1544774999999999,
"spacegroup": 63
},
{
"id": "jvasp-16523",
"created_at": "2022-09-04T14:37:53.793213Z",
"updated_at": "2022-09-04T14:37:53.793232Z",
"structure_string": "Pr2 Ga2\n1.0\n4.185540 -0.000000 0.000000\n0.000000 4.172108 -1.639240\n-0.000000 -0.008100 6.108321\nPr Ga\n2 2\ndirect\n0.750000 0.141700 0.283401 Pr\n0.250000 0.858300 0.716599 Pr\n0.750000 0.429211 0.858420 Ga\n0.250000 0.570790 0.141580 Ga\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Pr",
"Ga"
],
"chemical_system": "Ga-Pr",
"density": 6.561424009112533,
"density_atomic": 0.03751953382147786,
"volume": 106.61113272442157,
"volume_molar": 16.050681196237726,
"formula_full": "Pr2 Ga2",
"formula_reduced": "PrGa",
"formula_anonymous": "AB",
"energy_above_hull": 0.1545516166666667,
"spacegroup": 63
},
{
"id": "jvasp-38815",
"created_at": "2022-09-04T14:37:56.417229Z",
"updated_at": "2022-09-04T14:37:56.417252Z",
"structure_string": "Li1 Mg1 Au2\n1.0\n-0.000000 3.212633 3.212633\n3.212633 0.000000 3.212633\n3.212633 3.212633 0.000000\nLi Mg Au\n1 1 2\ndirect\n0.250000 0.250000 0.250000 Li\n0.749998 0.749998 0.749998 Mg\n0.500001 0.500001 0.500001 Au\n0.000000 0.000000 0.000000 Au\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Li",
"Mg",
"Au"
],
"chemical_system": "Au-Li-Mg",
"density": 10.646520646033544,
"density_atomic": 0.06031796033870022,
"volume": 66.31523973189766,
"volume_molar": 9.98399270496581,
"formula_full": "Li1 Mg1 Au2",
"formula_reduced": "LiMgAu2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.1546253387499999,
"spacegroup": 225
},
{
"id": "jvasp-123358",
"created_at": "2022-09-04T14:38:54.643891Z",
"updated_at": "2022-09-04T14:38:54.643917Z",
"structure_string": "Sm1 Ag3\n1.0\n4.441532 0.000000 0.000000\n-0.000000 4.441532 0.000000\n0.000000 -0.000000 4.441532\nSm Ag\n1 3\ndirect\n0.000000 0.000000 0.000000 Sm\n0.000000 0.500000 0.500000 Ag\n0.500000 0.000000 0.500000 Ag\n0.500000 0.500000 0.000000 Ag\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Sm",
"Ag"
],
"chemical_system": "Ag-Sm",
"density": 8.982487406540658,
"density_atomic": 0.045652188839258326,
"volume": 87.61901897155529,
"volume_molar": 13.19135163749541,
"formula_full": "Sm1 Ag3",
"formula_reduced": "SmAg3",
"formula_anonymous": "AB3",
"energy_above_hull": 0.15465766375,
"spacegroup": 221
},
{
"id": "jvasp-12165",
"created_at": "2022-09-04T14:36:01.684630Z",
"updated_at": "2022-09-04T14:36:01.684654Z",
"structure_string": "Nd2 I2 O2\n1.0\n4.085629 0.000000 0.000000\n0.000000 4.085629 0.000000\n-0.000000 0.000000 9.228210\nNd I O\n2 2 2\ndirect\n0.000000 0.500000 0.127029 Nd\n0.500000 0.000000 0.872971 Nd\n0.000000 0.500000 0.669220 I\n0.500000 0.000000 0.330780 I\n0.000000 0.000000 0.000000 O\n0.500000 0.500000 0.000000 O\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Nd",
"I",
"O"
],
"chemical_system": "I-Nd-O",
"density": 6.190793863795197,
"density_atomic": 0.03895075914914195,
"volume": 154.04064339352354,
"volume_molar": 15.460907287946048,
"formula_full": "Nd2 I2 O2",
"formula_reduced": "NdIO",
"formula_anonymous": "ABC",
"energy_above_hull": 0.1547137583333337,
"spacegroup": 129
},
{
"id": "jvasp-78318",
"created_at": "2022-09-04T14:37:15.106758Z",
"updated_at": "2022-09-04T14:37:15.106789Z",
"structure_string": "Mn1\n1.0\n-1.396082 -1.396082 1.396082\n-1.396082 1.396082 -1.396082\n1.396082 -1.396082 -1.396082\nMn\n1\ndirect\n0.000000 0.000000 0.000000 Mn\n",
"nsites": 1,
"nelements": 1,
"elements": [
"Mn"
],
"chemical_system": "Mn",
"density": 8.381650042837832,
"density_atomic": 0.09187708877604343,
"volume": 10.884106291586654,
"volume_molar": 6.554562013473643,
"formula_full": "Mn1",
"formula_reduced": "Mn",
"formula_anonymous": "A",
"energy_above_hull": 0.1550000000000002,
"spacegroup": 229
}
]
}