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=-formula_anonymous&page=3863",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-formula_anonymous&page=3861",
"results": [
{
"id": "jvasp-78499",
"created_at": "2022-09-04T14:37:15.495952Z",
"updated_at": "2022-09-04T14:37:15.495978Z",
"structure_string": "Nd1 Pd2\n1.0\n3.959702 -0.000000 -0.000000\n-0.000000 3.959702 -0.000000\n-1.979851 -1.979851 4.411589\nNd Pd\n1 2\ndirect\n0.000000 0.000000 0.000000 Nd\n0.250000 0.750000 0.500000 Pd\n0.750000 0.250000 0.500000 Pd\n",
"nsites": 3,
"nelements": 2,
"elements": [
"Nd",
"Pd"
],
"chemical_system": "Nd-Pd",
"density": 8.572292965093235,
"density_atomic": 0.04337117655574005,
"volume": 69.17036239827252,
"volume_molar": 13.885121959420275,
"formula_full": "Nd1 Pd2",
"formula_reduced": "NdPd2",
"formula_anonymous": "AB2",
"energy_above_hull": 1.2854043000000002,
"spacegroup": 139
},
{
"id": "jvasp-7740",
"created_at": "2022-09-04T14:37:06.162105Z",
"updated_at": "2022-09-04T14:37:06.162141Z",
"structure_string": "Cr3 Si6\n1.0\n2.217227 -3.840349 0.000000\n2.217227 3.840349 0.000000\n-0.000000 -0.000000 6.389550\nCr Si\n3 6\ndirect\n0.500000 0.000000 0.500000 Cr\n0.500001 0.500001 0.833333 Cr\n0.000000 0.500000 0.166667 Cr\n0.332816 0.166409 0.166667 Si\n0.166409 0.833592 0.833333 Si\n0.166409 0.332816 0.500000 Si\n0.667185 0.833593 0.166667 Si\n0.833592 0.166409 0.833333 Si\n0.833593 0.667185 0.500000 Si\n",
"nsites": 9,
"nelements": 2,
"elements": [
"Cr",
"Si"
],
"chemical_system": "Cr-Si",
"density": 4.952043120488199,
"density_atomic": 0.08271064140059793,
"volume": 108.81308435766691,
"volume_molar": 7.280974561462492,
"formula_full": "Cr3 Si6",
"formula_reduced": "CrSi2",
"formula_anonymous": "AB2",
"energy_above_hull": 3.2042915333333326,
"spacegroup": 180
},
{
"id": "jvasp-50035",
"created_at": "2022-09-04T14:37:16.059982Z",
"updated_at": "2022-09-04T14:37:16.059999Z",
"structure_string": "Zr4 O8\n1.0\n3.460798 -0.000000 0.000000\n0.000000 5.444067 0.000000\n0.000000 0.000000 7.708239\nZr O\n4 8\ndirect\n0.250000 0.145932 0.830974 Zr\n0.250000 0.354068 0.330974 Zr\n0.750001 0.645932 0.669026 Zr\n0.750001 0.854068 0.169026 Zr\n0.250000 0.107120 0.110333 O\n0.750001 0.127984 0.357745 O\n0.750001 0.372017 0.857746 O\n0.250000 0.392880 0.610333 O\n0.750001 0.607120 0.389667 O\n0.250000 0.627984 0.142255 O\n0.250000 0.872017 0.642255 O\n0.750001 0.892881 0.889668 O\n",
"nsites": 12,
"nelements": 2,
"elements": [
"Zr",
"O"
],
"chemical_system": "O-Zr",
"density": 5.635666401448888,
"density_atomic": 0.08262783273304061,
"volume": 145.22951411264026,
"volume_molar": 7.2882714707727185,
"formula_full": "Zr4 O8",
"formula_reduced": "ZrO2",
"formula_anonymous": "AB2",
"energy_above_hull": 1.4776571666666674,
"spacegroup": 62
},
{
"id": "jvasp-8268",
"created_at": "2022-09-04T14:37:06.814391Z",
"updated_at": "2022-09-04T14:37:06.814419Z",
"structure_string": "Co1 O2\n1.0\n4.712089 -0.513023 -0.303853\n4.165718 2.261365 -0.303854\n4.165718 0.820372 2.129104\nCo O\n1 2\ndirect\n0.000000 0.000000 0.000000 Co\n0.597832 0.597830 0.597832 O\n0.402170 0.402168 0.402170 O\n",
"nsites": 3,
"nelements": 2,
"elements": [
"Co",
"O"
],
"chemical_system": "Co-O",
"density": 4.888938082824026,
"density_atomic": 0.09713370957669622,
"volume": 30.885261286466335,
"volume_molar": 6.199846362549299,
"formula_full": "Co1 O2",
"formula_reduced": "CoO2",
"formula_anonymous": "AB2",
"energy_above_hull": 2.0732293000000004,
"spacegroup": 166
},
{
"id": "jvasp-8756",
"created_at": "2022-09-04T14:37:15.228135Z",
"updated_at": "2022-09-04T14:37:15.228150Z",
"structure_string": "Ag4 S2\n1.0\n4.229088 -0.065212 0.002307\n-1.471179 3.965486 -0.002307\n-2.761056 -3.898049 7.392398\nAg S\n4 2\ndirect\n0.041697 0.583400 0.312549 Ag\n0.541737 0.083304 0.812520 Ag\n0.406547 0.718271 0.062409 Ag\n0.676577 0.448232 0.562405 Ag\n0.067309 0.057858 0.562584 S\n0.016131 0.108939 0.062534 S\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Ag",
"S"
],
"chemical_system": "Ag-S",
"density": 6.676453390139703,
"density_atomic": 0.048675926092703686,
"volume": 123.26421871405081,
"volume_molar": 12.371907929457338,
"formula_full": "Ag4 S2",
"formula_reduced": "Ag2S",
"formula_anonymous": "AB2",
"energy_above_hull": 0.3907075,
"spacegroup": 63
},
{
"id": "jvasp-52591",
"created_at": "2022-09-04T14:37:09.051313Z",
"updated_at": "2022-09-04T14:37:09.051333Z",
"structure_string": "W4 C2\n1.0\n3.044145 0.000000 0.000000\n0.000000 4.713463 -0.000000\n0.000000 0.000000 5.300140\nW C\n4 2\ndirect\n0.500001 0.260894 0.157354 W\n0.000000 0.760894 0.342646 W\n0.000000 0.239105 0.657354 W\n0.500001 0.739105 0.842646 W\n0.000000 0.000000 0.000000 C\n0.500001 0.500000 0.500000 C\n",
"nsites": 6,
"nelements": 2,
"elements": [
"W",
"C"
],
"chemical_system": "C-W",
"density": 16.581212082887756,
"density_atomic": 0.07889663336689869,
"volume": 76.04887235299088,
"volume_molar": 7.632950232483059,
"formula_full": "W4 C2",
"formula_reduced": "W2C",
"formula_anonymous": "AB2",
"energy_above_hull": 6.446580000000001,
"spacegroup": 58
},
{
"id": "jvasp-34660",
"created_at": "2022-09-04T14:37:14.401744Z",
"updated_at": "2022-09-04T14:37:14.401764Z",
"structure_string": "Si4 O8\n1.0\n5.132921 -0.058086 0.002983\n0.465633 5.246286 -0.017214\n1.927633 2.031113 6.444338\nSi O\n4 8\ndirect\n0.387064 0.717927 0.593142 Si\n0.439352 0.634001 0.049238 Si\n0.179965 0.275097 0.440889 Si\n0.864586 0.695428 0.247041 Si\n0.450197 0.634479 0.818121 O\n0.169052 0.962278 0.573446 O\n0.263074 0.457479 0.568121 O\n0.726034 0.740791 0.054916 O\n0.668087 0.829630 0.414078 O\n0.177671 0.809609 0.139953 O\n0.890929 0.381167 0.386404 O\n0.398429 0.330573 0.211972 O\n",
"nsites": 12,
"nelements": 2,
"elements": [
"Si",
"O"
],
"chemical_system": "O-Si",
"density": 2.295378471583107,
"density_atomic": 0.0690184903117325,
"volume": 173.8664515233552,
"volume_molar": 8.725402037628012,
"formula_full": "Si4 O8",
"formula_reduced": "SiO2",
"formula_anonymous": "AB2",
"energy_above_hull": 1.4170452000000004,
"spacegroup": 1
},
{
"id": "jvasp-11154",
"created_at": "2022-09-04T14:37:09.388953Z",
"updated_at": "2022-09-04T14:37:09.388986Z",
"structure_string": "Ba8 Ge4\n1.0\n5.416558 -0.000000 0.000000\n0.000000 8.432030 0.000000\n0.000000 0.000000 10.166322\nBa Ge\n8 4\ndirect\n0.750000 0.352826 0.083972 Ba\n0.250000 0.647174 0.916028 Ba\n0.750000 0.852826 0.416028 Ba\n0.250000 0.147174 0.583972 Ba\n0.250000 0.019831 0.172850 Ba\n0.750000 0.980169 0.827150 Ba\n0.250000 0.519831 0.327150 Ba\n0.750000 0.480169 0.672850 Ba\n0.250000 0.748043 0.600574 Ge\n0.750000 0.251957 0.399426 Ge\n0.250000 0.248043 0.899426 Ge\n0.750000 0.751957 0.100574 Ge\n",
"nsites": 12,
"nelements": 2,
"elements": [
"Ba",
"Ge"
],
"chemical_system": "Ba-Ge",
"density": 4.968061542775785,
"density_atomic": 0.02584412566178312,
"volume": 464.32215030377074,
"volume_molar": 23.301777892626532,
"formula_full": "Ba8 Ge4",
"formula_reduced": "Ba2Ge",
"formula_anonymous": "AB2",
"energy_above_hull": 0.0,
"spacegroup": 62
},
{
"id": "jvasp-12133",
"created_at": "2022-09-04T14:37:06.898641Z",
"updated_at": "2022-09-04T14:37:06.898661Z",
"structure_string": "Te2 Au1\n1.0\n4.216450 0.048065 0.014377\n2.056419 3.681290 0.014377\n-0.013610 -0.008092 5.213753\nTe Au\n2 1\ndirect\n0.327566 0.327565 0.289070 Te\n0.672435 0.672434 0.710930 Te\n0.000000 0.000000 0.000000 Au\n",
"nsites": 3,
"nelements": 2,
"elements": [
"Te",
"Au"
],
"chemical_system": "Au-Te",
"density": 9.337256331056151,
"density_atomic": 0.03730722867124656,
"volume": 80.41337046061963,
"volume_molar": 16.142021196662583,
"formula_full": "Te2 Au1",
"formula_reduced": "Te2Au",
"formula_anonymous": "AB2",
"energy_above_hull": 0.6450577011111114,
"spacegroup": 164
},
{
"id": "jvasp-9147",
"created_at": "2022-09-04T14:37:10.215220Z",
"updated_at": "2022-09-04T14:37:10.215243Z",
"structure_string": "Hf4 O8\n1.0\n0.000000 5.117401 -0.012958\n5.192762 0.000000 0.000000\n0.000000 -0.877468 -5.222730\nHf O\n4 8\ndirect\n0.723500 0.541668 0.291936 Hf\n0.276499 0.041668 0.208064 Hf\n0.276499 0.458331 0.708064 Hf\n0.723500 0.958331 0.791936 Hf\n0.553006 0.258059 0.020437 O\n0.446993 0.758059 0.479564 O\n0.446993 0.741940 0.979564 O\n0.553006 0.241940 0.520436 O\n0.928672 0.663859 0.658334 O\n0.071328 0.163859 0.841666 O\n0.071328 0.336141 0.341666 O\n0.928672 0.836141 0.158334 O\n",
"nsites": 12,
"nelements": 2,
"elements": [
"Hf",
"O"
],
"chemical_system": "Hf-O",
"density": 10.069500285386184,
"density_atomic": 0.08642732742418358,
"volume": 138.844973663298,
"volume_molar": 6.9678664601572775,
"formula_full": "Hf4 O8",
"formula_reduced": "HfO2",
"formula_anonymous": "AB2",
"energy_above_hull": 1.7775599999999998,
"spacegroup": 14
},
{
"id": "jvasp-36410",
"created_at": "2022-09-04T14:37:18.961392Z",
"updated_at": "2022-09-04T14:37:18.961422Z",
"structure_string": "Be1 B2\n1.0\n1.463010 -2.534008 -0.000000\n1.463010 2.534008 0.000000\n-0.000000 -0.000000 2.902048\nBe B\n1 2\ndirect\n0.000000 0.000000 0.000000 Be\n0.666667 0.333333 0.500000 B\n0.333333 0.666667 0.500000 B\n",
"nsites": 3,
"nelements": 2,
"elements": [
"Be",
"B"
],
"chemical_system": "B-Be",
"density": 2.364098254409344,
"density_atomic": 0.13942202664438705,
"volume": 21.51740347062855,
"volume_molar": 4.319361082994589,
"formula_full": "Be1 B2",
"formula_reduced": "BeB2",
"formula_anonymous": "AB2",
"energy_above_hull": 3.227510422222222,
"spacegroup": 191
},
{
"id": "jvasp-85205",
"created_at": "2022-09-04T14:37:15.157735Z",
"updated_at": "2022-09-04T14:37:15.157757Z",
"structure_string": "Pd2 N4\n1.0\n2.882321 -0.000000 0.000000\n0.000000 4.997153 0.000000\n0.000000 0.000000 6.874135\nPd N\n2 4\ndirect\n0.500000 0.500000 0.500000 Pd\n0.000000 0.000000 0.000000 Pd\n0.500000 0.113844 0.500000 N\n0.500000 0.886156 0.500000 N\n0.000000 0.386156 0.000000 N\n-0.000000 0.613844 0.000000 N\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Pd",
"N"
],
"chemical_system": "N-Pd",
"density": 4.5092387070471,
"density_atomic": 0.06059938279548606,
"volume": 99.0109094056141,
"volume_molar": 9.937627220270267,
"formula_full": "Pd2 N4",
"formula_reduced": "PdN2",
"formula_anonymous": "AB2",
"energy_above_hull": 3.6532007333333327,
"spacegroup": 71
}
]
}