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=structure_string&page=1112",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=structure_string&page=1110",
"results": [
{
"id": "jvasp-36176",
"created_at": "2022-09-04T14:37:11.867338Z",
"updated_at": "2022-09-04T14:37:11.867362Z",
"structure_string": "Cr3 Ni1\n1.0\n3.575379 -0.000000 0.000000\n-0.000000 3.575379 0.000000\n-1.787690 -1.787690 3.562197\nCr Ni\n3 1\ndirect\n0.500000 0.500000 -0.000000 Cr\n0.250000 0.750000 0.500000 Cr\n0.750000 0.250000 0.500000 Cr\n0.000000 0.000000 0.000000 Ni\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Cr",
"Ni"
],
"chemical_system": "Cr-Ni",
"density": 7.828562436189886,
"density_atomic": 0.08784112470783717,
"volume": 45.536757564342984,
"volume_molar": 6.855719095161706,
"formula_full": "Cr3 Ni1",
"formula_reduced": "Cr3Ni",
"formula_anonymous": "AB3",
"energy_above_hull": 3.88532365,
"spacegroup": 139
},
{
"id": "jvasp-106826",
"created_at": "2022-09-04T14:37:01.853419Z",
"updated_at": "2022-09-04T14:37:01.853445Z",
"structure_string": "Cr3 Ni1 B6\n1.0\n8.997979 0.009052 0.000000\n-8.502534 2.944591 0.000000\n0.000000 0.000000 2.952022\nCr Ni B\n3 1 6\ndirect\n0.796420 0.203579 0.500000 Cr\n0.929053 0.070946 -0.000000 Cr\n0.071897 0.928103 0.500000 Cr\n0.202677 0.797323 -0.000000 Ni\n0.524519 0.475481 -0.000000 B\n0.475996 0.524004 0.500000 B\n0.324820 0.675179 -0.000000 B\n0.674473 0.325526 0.500000 B\n0.621274 0.378725 -0.000000 B\n0.378872 0.621128 0.500000 B\n",
"nsites": 10,
"nelements": 3,
"elements": [
"Cr",
"Ni",
"B"
],
"chemical_system": "B-Cr-Ni",
"density": 5.917738173096294,
"density_atomic": 0.12748254509526163,
"volume": 78.4421113692661,
"volume_molar": 4.723894361773168,
"formula_full": "Cr3 Ni1 B6",
"formula_reduced": "Cr3NiB6",
"formula_anonymous": "AB3C6",
"energy_above_hull": 5.030112010000001,
"spacegroup": 38
},
{
"id": "jvasp-106103",
"created_at": "2022-09-04T14:36:14.130812Z",
"updated_at": "2022-09-04T14:36:14.130839Z",
"structure_string": "Cr3 Ni1 P4\n1.0\n3.119801 0.000000 0.000000\n0.000000 5.351394 0.008237\n0.000000 -0.000877 5.970395\nCr Ni P\n3 1 4\ndirect\n0.000000 0.007226 0.808136 Cr\n0.500000 0.493730 0.292392 Cr\n0.500000 0.995007 0.198455 Cr\n0.000000 0.505519 0.696054 Ni\n0.000000 0.699099 0.070074 P\n0.000000 0.187936 0.437068 P\n0.500000 0.303426 0.930216 P\n0.500000 0.808053 0.567613 P\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Cr",
"Ni",
"P"
],
"chemical_system": "Cr-Ni-P",
"density": 5.640391421011324,
"density_atomic": 0.08025886311735729,
"volume": 99.67746475927677,
"volume_molar": 7.503396542253803,
"formula_full": "Cr3 Ni1 P4",
"formula_reduced": "Cr3NiP4",
"formula_anonymous": "AB3C4",
"energy_above_hull": 3.914872075,
"spacegroup": 6
},
{
"id": "jvasp-43180",
"created_at": "2022-09-04T14:36:19.236025Z",
"updated_at": "2022-09-04T14:36:19.236053Z",
"structure_string": "Cr3 Ni1 P4 O16\n1.0\n0.000000 4.694010 -0.004418\n5.634675 0.000000 0.000000\n0.000000 -0.039537 -9.736942\nCr Ni P O\n3 1 4 16\ndirect\n0.448940 0.500000 0.229408 Cr\n0.557339 0.000000 0.769497 Cr\n0.945789 0.000000 0.267685 Cr\n0.060331 0.500000 0.730978 Ni\n0.125953 0.000000 0.588505 P\n0.383261 0.000000 0.084592 P\n0.603542 0.500000 0.913335 P\n0.886155 0.500000 0.413580 P\n0.731113 0.288382 0.332578 O\n0.806878 0.000000 0.616100 O\n0.703006 0.000000 0.108685 O\n0.750912 0.716777 0.837787 O\n0.750912 0.283224 0.837787 O\n0.681704 0.500000 0.066711 O\n0.313661 0.000000 0.932366 O\n0.205350 0.500000 0.385801 O\n0.230739 0.788325 0.164158 O\n0.283536 0.500000 0.897452 O\n0.731113 0.711618 0.332578 O\n0.285669 0.209883 0.664055 O\n0.285669 0.790118 0.664055 O\n0.177540 0.000000 0.434117 O\n0.230739 0.211676 0.164158 O\n0.820137 0.500000 0.564031 O\n",
"nsites": 24,
"nelements": 4,
"elements": [
"Cr",
"Ni",
"P",
"O"
],
"chemical_system": "Cr-Ni-O-P",
"density": 3.8336537170148284,
"density_atomic": 0.09319103106694546,
"volume": 257.53551307699524,
"volume_molar": 6.462146293535358,
"formula_full": "Cr3 Ni1 P4 O16",
"formula_reduced": "Cr3Ni(PO4)4",
"formula_anonymous": "AB3C4D16",
"energy_above_hull": 3.415700108333334,
"spacegroup": 6
},
{
"id": "jvasp-101210",
"created_at": "2022-09-04T14:36:49.218810Z",
"updated_at": "2022-09-04T14:36:49.218839Z",
"structure_string": "Cr3 Ni1 Sb4\n1.0\n4.015579 0.000000 0.000000\n-2.007790 3.477593 0.000000\n-0.000000 -0.000000 11.296345\nCr Ni Sb\n3 1 4\ndirect\n0.000000 0.000000 0.500000 Cr\n0.000000 0.000000 0.242508 Cr\n0.000000 0.000000 0.757493 Cr\n0.000000 0.000000 0.000000 Ni\n0.333333 0.666666 0.887437 Sb\n0.333333 0.666666 0.371127 Sb\n0.666667 0.333333 0.112563 Sb\n0.666667 0.333333 0.628873 Sb\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Cr",
"Ni",
"Sb"
],
"chemical_system": "Cr-Ni-Sb",
"density": 7.386677347347067,
"density_atomic": 0.05071367837112637,
"volume": 157.74836803308608,
"volume_molar": 11.874785961944108,
"formula_full": "Cr3 Ni1 Sb4",
"formula_reduced": "Cr3NiSb4",
"formula_anonymous": "AB3C4",
"energy_above_hull": 3.189428625,
"spacegroup": 164
},
{
"id": "jvasp-15495",
"created_at": "2022-09-04T14:36:06.896982Z",
"updated_at": "2022-09-04T14:36:06.897009Z",
"structure_string": "Cr3 Ni3 As3\n1.0\n3.118294 -5.401043 -0.000000\n3.118294 5.401043 0.000000\n0.000000 -0.000000 3.621481\nCr Ni As\n3 3 3\ndirect\n0.595847 0.595847 0.500000 Cr\n-0.000000 0.404152 0.500000 Cr\n0.404152 -0.000000 0.500000 Cr\n0.256449 0.256449 0.000000 Ni\n0.743550 -0.000000 0.000000 Ni\n-0.000000 0.743550 0.000000 Ni\n0.666666 0.333332 0.000000 As\n0.333332 0.666666 0.000000 As\n0.000000 0.000000 0.500000 As\n",
"nsites": 9,
"nelements": 3,
"elements": [
"Cr",
"Ni",
"As"
],
"chemical_system": "As-Cr-Ni",
"density": 7.579898602676544,
"density_atomic": 0.07377880366145154,
"volume": 121.98625558227074,
"volume_molar": 8.162426687797446,
"formula_full": "Cr3 Ni3 As3",
"formula_reduced": "CrNiAs",
"formula_anonymous": "ABC",
"energy_above_hull": 2.3612305166666667,
"spacegroup": 189
},
{
"id": "jvasp-89992",
"created_at": "2022-09-04T14:36:01.116854Z",
"updated_at": "2022-09-04T14:36:01.116881Z",
"structure_string": "Cr3 Ni3 P3\n1.0\n0.000000 0.000000 -3.523895\n-2.954587 -5.117495 0.000000\n-2.954436 5.117407 0.000000\nCr Ni P\n3 3 3\ndirect\n0.499999 0.595294 0.000001 Cr\n0.499999 0.404691 0.404732 Cr\n0.499999 0.999959 0.595270 Cr\n0.000000 0.255972 0.000000 Ni\n0.000000 0.744021 0.744032 Ni\n0.000000 -0.000010 0.255970 Ni\n0.000000 0.333319 0.666665 P\n0.000000 0.666655 0.333337 P\n0.499999 0.000000 0.000000 P\n",
"nsites": 9,
"nelements": 3,
"elements": [
"Cr",
"Ni",
"P"
],
"chemical_system": "Cr-Ni-P",
"density": 6.622702665716096,
"density_atomic": 0.08445982490157304,
"volume": 106.55953893449734,
"volume_molar": 7.130183808713816,
"formula_full": "Cr3 Ni3 P3",
"formula_reduced": "CrNiP",
"formula_anonymous": "ABC",
"energy_above_hull": 2.457588433333333,
"spacegroup": 189
},
{
"id": "jvasp-90436",
"created_at": "2022-09-04T14:38:17.664261Z",
"updated_at": "2022-09-04T14:38:17.664279Z",
"structure_string": "Cr3 O5\n1.0\n4.910930 0.402765 3.006874\n2.112204 4.268385 3.063028\n0.040293 0.097781 5.203730\nCr O\n3 5\ndirect\n0.848613 0.909471 0.801507 Cr\n0.209727 0.098937 0.158751 Cr\n0.280783 0.350723 0.390456 Cr\n0.107282 0.766992 0.406084 O\n0.468167 0.048864 0.752278 O\n0.974412 0.203877 0.574184 O\n0.570074 -0.012993 0.206526 O\n0.140628 0.534991 0.008734 O\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Cr",
"O"
],
"chemical_system": "Cr-O",
"density": 3.7921579671838157,
"density_atomic": 0.07741807331364571,
"volume": 103.33504384162865,
"volume_molar": 7.778727243188236,
"formula_full": "Cr3 O5",
"formula_reduced": "Cr3O5",
"formula_anonymous": "A3B5",
"energy_above_hull": 3.6270312125,
"spacegroup": 1
},
{
"id": "jvasp-29509",
"created_at": "2022-09-04T14:37:06.142893Z",
"updated_at": "2022-09-04T14:37:06.142928Z",
"structure_string": "Cr3 O8\n1.0\n5.418067 -0.919837 -1.173538\n-2.285866 5.041766 -0.966270\n-0.519893 -0.663071 5.293283\nCr O\n3 8\ndirect\n0.409046 0.240013 0.649079 Cr\n-0.000000 0.500001 0.500000 Cr\n0.590954 0.759986 0.350918 Cr\n0.281536 0.938775 0.734534 O\n0.229450 0.074177 0.303612 O\n0.795724 0.452944 0.734521 O\n0.770554 0.925821 0.696385 O\n0.712989 0.541250 0.254220 O\n0.718465 0.061227 0.265467 O\n0.204277 0.547058 0.265481 O\n0.287011 0.458749 0.745779 O\n",
"nsites": 11,
"nelements": 2,
"elements": [
"Cr",
"O"
],
"chemical_system": "Cr-O",
"density": 3.782311151418345,
"density_atomic": 0.08822826388087139,
"volume": 124.6766004015737,
"volume_molar": 6.82563670087772,
"formula_full": "Cr3 O8",
"formula_reduced": "Cr3O8",
"formula_anonymous": "A3B8",
"energy_above_hull": 3.5419654727272727,
"spacegroup": 12
},
{
"id": "jvasp-102777",
"created_at": "2022-09-04T14:36:46.206506Z",
"updated_at": "2022-09-04T14:36:46.206525Z",
"structure_string": "Cr3 Os1\n1.0\n2.581059 -0.000969 0.000000\n-0.980410 2.387606 0.000000\n-0.000000 -0.000000 8.103732\nCr Os\n3 1\ndirect\n0.500001 0.500001 0.734789 Cr\n0.000000 0.000000 0.500000 Cr\n0.500001 0.500001 0.265211 Cr\n0.000000 0.000000 0.000000 Os\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Cr",
"Os"
],
"chemical_system": "Cr-Os",
"density": 11.513845810693041,
"density_atomic": 0.080108995029889,
"volume": 49.93197079188902,
"volume_molar": 7.517433913324109,
"formula_full": "Cr3 Os1",
"formula_reduced": "Cr3Os",
"formula_anonymous": "AB3",
"energy_above_hull": 5.118664300000001,
"spacegroup": 65
},
{
"id": "jvasp-90102",
"created_at": "2022-09-04T14:36:12.282850Z",
"updated_at": "2022-09-04T14:36:12.282892Z",
"structure_string": "Cr3 P3 Pd3\n1.0\n0.000000 0.000000 -3.674828\n-2.966405 -5.137965 0.000000\n-3.406359 5.391972 0.000000\nCr P Pd\n3 3 3\ndirect\n0.500000 0.586548 0.000000 Cr\n0.500000 0.427387 0.364267 Cr\n0.500000 0.063120 0.635734 Cr\n0.000000 0.318730 0.671503 P\n0.000000 0.647228 0.328497 P\n0.500000 0.987051 0.000000 P\n0.000000 0.248177 0.000000 Pd\n0.000000 0.723804 0.725941 Pd\n0.000000 -0.002140 0.274059 Pd\n",
"nsites": 9,
"nelements": 3,
"elements": [
"Cr",
"P",
"Pd"
],
"chemical_system": "Cr-P-Pd",
"density": 7.664614122148172,
"density_atomic": 0.07311487211064835,
"volume": 123.09397172137366,
"volume_molar": 8.236546937928575,
"formula_full": "Cr3 P3 Pd3",
"formula_reduced": "CrPPd",
"formula_anonymous": "ABC",
"energy_above_hull": 2.7478162,
"spacegroup": 38
},
{
"id": "jvasp-15968",
"created_at": "2022-09-04T14:38:16.144325Z",
"updated_at": "2022-09-04T14:38:16.144353Z",
"structure_string": "Cr3 Pd1 N1\n1.0\n3.834064 0.000000 0.000000\n0.000000 3.834064 0.000000\n0.000000 0.000000 3.834064\nCr Pd N\n3 1 1\ndirect\n0.500000 0.000000 0.500000 Cr\n0.000000 0.500000 0.500000 Cr\n0.500000 0.500000 0.000000 Cr\n0.000000 0.000000 0.000000 Pd\n0.500000 0.500000 0.500000 N\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Cr",
"Pd",
"N"
],
"chemical_system": "Cr-N-Pd",
"density": 8.143903711256758,
"density_atomic": 0.08871395275586175,
"volume": 56.360920065864455,
"volume_molar": 6.788267879994885,
"formula_full": "Cr3 Pd1 N1",
"formula_reduced": "Cr3PdN",
"formula_anonymous": "ABC3",
"energy_above_hull": 4.46490423,
"spacegroup": 221
}
]
}