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_reduced&page=1068",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=formula_reduced&page=1066",
"results": [
{
"id": "jvasp-100484",
"created_at": "2022-09-04T14:36:45.190383Z",
"updated_at": "2022-09-04T14:36:45.190402Z",
"structure_string": "Co1 Pd3\n1.0\n3.858533 -0.000000 0.000000\n0.000000 3.858533 -0.000000\n0.000000 0.000000 3.858533\nCo Pd\n1 3\ndirect\n0.000000 0.000000 0.000000 Co\n0.000000 0.500000 0.500000 Pd\n0.500000 0.000000 0.500000 Pd\n0.500000 0.500000 0.000000 Pd\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Co",
"Pd"
],
"chemical_system": "Co-Pd",
"density": 10.931912600795107,
"density_atomic": 0.06962950931018892,
"volume": 57.446907778433506,
"volume_molar": 8.648834121711637,
"formula_full": "Co1 Pd3",
"formula_reduced": "CoPd3",
"formula_anonymous": "AB3",
"energy_above_hull": 2.0812395,
"spacegroup": 221
},
{
"id": "jvasp-110774",
"created_at": "2022-09-04T14:38:43.178575Z",
"updated_at": "2022-09-04T14:38:43.178600Z",
"structure_string": "Co2 Pd6\n1.0\n5.471357 -0.000000 0.000000\n-2.735679 4.738334 0.000000\n-0.000000 -0.000000 4.439282\nCo Pd\n2 6\ndirect\n0.333333 0.666666 0.750000 Co\n0.666667 0.333333 0.250000 Co\n0.169691 0.339381 0.250000 Pd\n0.660618 0.830308 0.250000 Pd\n0.169691 0.830308 0.250000 Pd\n0.830309 0.660618 0.750000 Pd\n0.339382 0.169691 0.750000 Pd\n0.830309 0.169691 0.750000 Pd\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Co",
"Pd"
],
"chemical_system": "Co-Pd",
"density": 10.913381722039945,
"density_atomic": 0.06951147909517287,
"volume": 115.08890479868309,
"volume_molar": 8.663519807648862,
"formula_full": "Co2 Pd6",
"formula_reduced": "CoPd3",
"formula_anonymous": "AB3",
"energy_above_hull": 2.0796545,
"spacegroup": 194
},
{
"id": "jvasp-17459",
"created_at": "2022-09-04T14:38:13.784004Z",
"updated_at": "2022-09-04T14:38:13.784034Z",
"structure_string": "Co1 Pd1 O2\n1.0\n2.773861 -0.001773 5.516755\n1.307466 2.446393 5.516755\n-0.002960 -0.001773 6.174859\nCo Pd O\n1 1 2\ndirect\n0.500000 0.500000 0.499999 Co\n-0.000000 -0.000000 -0.000000 Pd\n0.887527 0.887527 0.887526 O\n0.112474 0.112474 0.112474 O\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Co",
"Pd",
"O"
],
"chemical_system": "Co-O-Pd",
"density": 7.808037182951439,
"density_atomic": 0.09530402566499907,
"volume": 41.970944795766606,
"volume_molar": 6.318873434757399,
"formula_full": "Co1 Pd1 O2",
"formula_reduced": "CoPdO2",
"formula_anonymous": "ABC2",
"energy_above_hull": 2.1891334,
"spacegroup": 166
},
{
"id": "jvasp-21790",
"created_at": "2022-09-04T14:38:27.857633Z",
"updated_at": "2022-09-04T14:38:27.857656Z",
"structure_string": "Co2 Pd4 Se4\n1.0\n4.665483 -0.000000 -1.931740\n-1.143734 5.235088 -2.762313\n0.009908 0.025967 6.623772\nCo Pd Se\n2 4 4\ndirect\n0.749999 0.000000 -0.000000 Co\n0.250000 0.000000 -0.000000 Co\n0.887382 0.265291 0.774764 Pd\n0.112619 0.734710 0.225237 Pd\n0.612619 0.490528 0.225236 Pd\n0.387382 0.509473 0.774765 Pd\n0.642143 0.933831 0.284287 Se\n0.357857 0.066170 0.715714 Se\n0.142143 0.350456 0.284286 Se\n0.857857 0.649545 0.715715 Se\n",
"nsites": 10,
"nelements": 3,
"elements": [
"Co",
"Pd",
"Se"
],
"chemical_system": "Co-Pd-Se",
"density": 8.794117299323405,
"density_atomic": 0.06162468113414997,
"volume": 162.27264492016,
"volume_molar": 9.772287092067023,
"formula_full": "Co2 Pd4 Se4",
"formula_reduced": "Co(PdSe)2",
"formula_anonymous": "AB2C2",
"energy_above_hull": 1.9497258066666667,
"spacegroup": 72
},
{
"id": "jvasp-52437",
"created_at": "2022-09-04T14:38:16.507248Z",
"updated_at": "2022-09-04T14:38:16.507268Z",
"structure_string": "Co2 P2 H12 N2 O10\n1.0\n4.752583 0.000000 0.000000\n0.000000 5.620982 0.000000\n0.000000 0.000000 8.835422\nCo P H N O\n2 2 12 2 10\ndirect\n0.520164 0.500000 0.022644 Co\n0.020165 0.000000 0.977356 Co\n0.086506 0.500000 0.808504 P\n0.586506 0.000000 0.191495 P\n0.594332 0.140801 0.808631 H\n0.594332 0.859199 0.808631 H\n0.094333 0.640801 0.191369 H\n0.149738 0.152488 0.593563 H\n0.149738 0.847512 0.593563 H\n0.094333 0.359199 0.191369 H\n0.649737 0.652488 0.406437 H\n0.979746 0.000000 0.454571 H\n0.479747 0.500000 0.545428 H\n0.342832 0.000000 0.462694 H\n0.842832 0.500000 0.537306 H\n0.649737 0.347512 0.406437 H\n0.655883 0.500000 0.472736 N\n0.155884 0.000000 0.527263 N\n0.731638 0.219467 0.112781 O\n0.731638 0.780533 0.112781 O\n0.231638 0.280533 0.887219 O\n0.231638 0.719467 0.887219 O\n0.768079 0.500000 0.830586 O\n0.154763 0.500000 0.637072 O\n0.268080 0.000000 0.169413 O\n0.215415 0.500000 0.208321 O\n0.654763 0.000000 0.362928 O\n0.715415 0.000000 0.791679 O\n",
"nsites": 28,
"nelements": 5,
"elements": [
"Co",
"P",
"H",
"N",
"O"
],
"chemical_system": "Co-H-N-O-P",
"density": 2.672810437307585,
"density_atomic": 0.11862844273317646,
"volume": 236.03108457706597,
"volume_molar": 5.076472910923416,
"formula_full": "Co2 P2 H12 N2 O10",
"formula_reduced": "CoPH6NO5",
"formula_anonymous": "ABCD5E6",
"energy_above_hull": 3.352380510714285,
"spacegroup": 31
},
{
"id": "jvasp-30145",
"created_at": "2022-09-04T14:36:46.689576Z",
"updated_at": "2022-09-04T14:36:46.689607Z",
"structure_string": "Co2 P2 H12 O12 F2\n1.0\n4.662550 0.043509 -0.778757\n-0.247927 5.579127 -0.590455\n0.108080 -0.073585 10.239612\nCo P H O F\n2 2 12 12 2\ndirect\n0.000000 0.000000 0.000000 Co\n0.500000 -0.000000 0.500000 Co\n0.063387 0.827613 0.692414 P\n0.936612 0.172387 0.307586 P\n0.127669 0.253316 0.612911 H\n0.351388 0.459065 0.595414 H\n0.648612 0.540935 0.404586 H\n0.530997 0.220596 0.896835 H\n0.469002 0.779403 0.103165 H\n0.872330 0.746684 0.387089 H\n0.255380 0.814060 0.211617 H\n0.259523 0.439632 0.076329 H\n0.740476 0.560367 0.923671 H\n0.491153 0.232773 0.104353 H\n0.508846 0.767227 0.895646 H\n0.744619 0.185940 0.788383 H\n0.331263 0.285840 0.607147 O\n0.668737 0.714159 0.392853 O\n0.732292 0.242157 0.883736 O\n0.267707 0.757843 0.116264 O\n0.308081 0.271781 0.047169 O\n0.691918 0.728219 0.952831 O\n0.724332 0.235889 0.402236 O\n0.854659 0.021841 0.652262 O\n0.275668 0.764111 0.597764 O\n0.798067 0.123114 0.161295 O\n0.201932 0.876886 0.838705 O\n0.145341 0.978159 0.347738 O\n0.871210 0.587390 0.684130 F\n0.128790 0.412610 0.315870 F\n",
"nsites": 30,
"nelements": 5,
"elements": [
"Co",
"P",
"H",
"O",
"F"
],
"chemical_system": "Co-F-H-O-P",
"density": 2.626617268501787,
"density_atomic": 0.11247620688208138,
"volume": 266.7230770988892,
"volume_molar": 5.354146380766144,
"formula_full": "Co2 P2 H12 O12 F2",
"formula_reduced": "CoPH6O6F",
"formula_anonymous": "ABCD6E6",
"energy_above_hull": 2.8908231788333336,
"spacegroup": 2
},
{
"id": "jvasp-44368",
"created_at": "2022-09-04T14:38:08.520621Z",
"updated_at": "2022-09-04T14:38:08.520650Z",
"structure_string": "Co2 P2 H2 O10\n1.0\n5.052927 -0.133840 0.068985\n-0.942746 4.984495 -0.001138\n-2.097516 -2.269238 6.118744\nCo P H O\n2 2 2 10\ndirect\n-0.000001 -0.000000 0.500000 Co\n0.000000 0.000000 0.000000 Co\n0.681621 0.324268 0.245136 P\n0.318378 0.675731 0.754864 P\n0.313344 -0.074985 0.302638 H\n0.686656 0.074985 0.697362 H\n0.898235 0.088375 0.745851 O\n0.672293 0.098706 0.362110 O\n0.249316 0.374338 0.587334 O\n0.375304 0.242837 0.072524 O\n0.909688 0.325045 0.136424 O\n0.090310 0.674954 0.863576 O\n0.624694 0.757162 0.927475 O\n0.750683 0.625661 0.412666 O\n0.327706 0.901293 0.637890 O\n0.101763 0.911624 0.254149 O\n",
"nsites": 16,
"nelements": 4,
"elements": [
"Co",
"P",
"H",
"O"
],
"chemical_system": "Co-H-O-P",
"density": 3.6812043207528338,
"density_atomic": 0.10376682247487919,
"volume": 154.19186613210042,
"volume_molar": 5.803532011841159,
"formula_full": "Co2 P2 H2 O10",
"formula_reduced": "CoPHO5",
"formula_anonymous": "ABCD5",
"energy_above_hull": 2.8540417375,
"spacegroup": 2
},
{
"id": "jvasp-118139",
"created_at": "2022-09-04T14:38:47.422183Z",
"updated_at": "2022-09-04T14:38:47.422211Z",
"structure_string": "Co1 P1 O1\n1.0\n6.350127 0.000000 0.000000\n0.000000 6.350127 0.000000\n0.000000 0.000000 4.762595\nCo P O\n1 1 1\ndirect\n0.288159 0.001254 0.000000 Co\n-0.058691 -0.077103 0.000000 P\n0.046113 0.264517 0.000000 O\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Co",
"P",
"O"
],
"chemical_system": "Co-O-P",
"density": 0.9157199014915607,
"density_atomic": 0.015621142021024966,
"volume": 192.04741855379137,
"volume_molar": 38.55121957085225,
"formula_full": "Co1 P1 O1",
"formula_reduced": "CoPO",
"formula_anonymous": "ABC",
"energy_above_hull": 3.1779466333333337,
"spacegroup": 6
},
{
"id": "jvasp-113183",
"created_at": "2022-09-04T14:38:47.648437Z",
"updated_at": "2022-09-04T14:38:47.648468Z",
"structure_string": "Co4 P4 O16\n1.0\n4.536485 -0.000000 0.000000\n0.000000 5.416410 0.000000\n-0.000000 -0.000000 9.530762\nCo P O\n4 4 16\ndirect\n0.446447 0.750000 0.234315 Co\n0.946448 0.250000 0.265685 Co\n0.053553 0.750000 0.734315 Co\n0.553554 0.250000 0.765685 Co\n0.384150 0.250000 0.084823 P\n0.884150 0.750000 0.415177 P\n0.115851 0.250000 0.584823 P\n0.615851 0.750000 0.915177 P\n0.780777 0.970579 0.835448 O\n0.780777 0.529421 0.835448 O\n0.280777 0.470579 0.664551 O\n0.280777 0.029421 0.664551 O\n0.783374 0.250000 0.603216 O\n0.810013 0.750000 0.570424 O\n0.189988 0.250000 0.429575 O\n0.219224 0.470579 0.164552 O\n0.719224 0.970579 0.335448 O\n0.719224 0.529421 0.335448 O\n0.283373 0.750000 0.896783 O\n0.219224 0.029421 0.164552 O\n0.716628 0.250000 0.103217 O\n0.689988 0.750000 0.070424 O\n0.216627 0.750000 0.396783 O\n0.310013 0.250000 0.929575 O\n",
"nsites": 24,
"nelements": 3,
"elements": [
"Co",
"P",
"O"
],
"chemical_system": "Co-O-P",
"density": 4.365177750628455,
"density_atomic": 0.1024831832593074,
"volume": 234.18476316523225,
"volume_molar": 5.876223365117884,
"formula_full": "Co4 P4 O16",
"formula_reduced": "CoPO4",
"formula_anonymous": "ABC4",
"energy_above_hull": 2.6572484000000003,
"spacegroup": 62
},
{
"id": "jvasp-43656",
"created_at": "2022-09-04T14:35:43.637009Z",
"updated_at": "2022-09-04T14:35:43.637037Z",
"structure_string": "Co4 P4 O16\n1.0\n4.693826 0.000000 0.000000\n-0.000000 6.333415 0.000000\n0.000000 0.000000 8.410194\nCo P O\n4 4 16\ndirect\n0.000000 0.500000 0.000000 Co\n0.000000 0.000000 0.000000 Co\n0.500000 0.500000 0.500000 Co\n0.500000 0.000000 0.500000 Co\n0.462267 0.749999 0.820366 P\n0.962268 0.250000 0.679634 P\n0.037733 0.749999 0.320366 P\n0.537734 0.250000 0.179634 P\n0.685651 0.045250 0.125364 O\n0.079031 0.749999 0.131333 O\n0.579031 0.250000 0.368666 O\n0.185651 0.545249 0.374636 O\n0.185651 0.954750 0.374636 O\n0.725717 0.749999 0.375520 O\n0.274284 0.250000 0.624480 O\n0.920970 0.250000 0.868666 O\n0.814350 0.454750 0.625363 O\n0.420969 0.749999 0.631333 O\n0.685651 0.454750 0.125364 O\n0.314350 0.954750 0.874636 O\n0.314350 0.545249 0.874636 O\n0.774284 0.749999 0.875520 O\n0.814350 0.045250 0.625363 O\n0.225716 0.250000 0.124480 O\n",
"nsites": 24,
"nelements": 3,
"elements": [
"Co",
"P",
"O"
],
"chemical_system": "Co-O-P",
"density": 4.088741191081116,
"density_atomic": 0.09599316149843325,
"volume": 250.01780986650508,
"volume_molar": 6.273510181345876,
"formula_full": "Co4 P4 O16",
"formula_reduced": "CoPO4",
"formula_anonymous": "ABC4",
"energy_above_hull": 2.6592234,
"spacegroup": 62
},
{
"id": "jvasp-42697",
"created_at": "2022-09-04T14:37:01.309359Z",
"updated_at": "2022-09-04T14:37:01.309372Z",
"structure_string": "Co2 P2 O8\n1.0\n5.008032 0.014478 -0.020146\n2.294744 7.309089 4.155757\n2.334975 -1.523227 4.160369\nCo P O\n2 2 8\ndirect\n0.196043 0.253254 0.301379 Co\n0.801379 0.753254 0.696043 Co\n0.183947 0.625476 0.067091 P\n0.567091 0.125476 0.683947 P\n0.071947 0.745494 0.291315 O\n0.293309 0.457113 0.216716 O\n0.267455 0.187910 0.945953 O\n0.484231 0.112717 0.429093 O\n0.445952 0.687910 0.767455 O\n0.791315 0.245494 0.571948 O\n0.929094 0.612717 0.984231 O\n0.716716 0.957113 0.793309 O\n",
"nsites": 12,
"nelements": 3,
"elements": [
"Co",
"P",
"O"
],
"chemical_system": "Co-O-P",
"density": 2.77177536058287,
"density_atomic": 0.06507417989825294,
"volume": 184.40493631671825,
"volume_molar": 9.254270694484278,
"formula_full": "Co2 P2 O8",
"formula_reduced": "CoPO4",
"formula_anonymous": "ABC4",
"energy_above_hull": 2.669936733333333,
"spacegroup": 9
},
{
"id": "jvasp-118140",
"created_at": "2022-09-04T14:38:49.308650Z",
"updated_at": "2022-09-04T14:38:49.308682Z",
"structure_string": "Co1 P1 O4\n1.0\n-2.365411 2.365411 3.817272\n2.365411 -2.365411 3.817272\n2.365411 2.365411 -3.817272\nCo P O\n1 1 4\ndirect\n0.250000 0.749999 0.500000 Co\n0.000000 0.000000 0.000000 P\n0.274961 0.331841 0.379975 O\n0.668159 0.048135 -0.056880 O\n0.951864 0.894984 0.620024 O\n0.105014 0.725038 0.056880 O\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Co",
"P",
"O"
],
"chemical_system": "Co-O-P",
"density": 2.9913983815661997,
"density_atomic": 0.07023036541765289,
"volume": 85.43313087321425,
"volume_molar": 8.574838994766633,
"formula_full": "Co1 P1 O4",
"formula_reduced": "CoPO4",
"formula_anonymous": "ABC4",
"energy_above_hull": 2.6711517333333337,
"spacegroup": 82
}
]
}