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=volume&page=4205",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=volume&page=4203",
"results": [
{
"id": "jvasp-56342",
"created_at": "2022-09-04T14:37:33.475634Z",
"updated_at": "2022-09-04T14:37:33.475660Z",
"structure_string": "Sr4 P12\n1.0\n6.720868 -0.006347 1.339519\n2.598656 6.198154 1.339519\n0.002508 0.001666 8.613095\nSr P\n4 12\ndirect\n0.042042 0.042042 0.259377 Sr\n0.707045 0.707044 0.225149 Sr\n0.292956 0.292956 0.774851 Sr\n0.957959 0.957958 0.740623 Sr\n0.359969 0.837658 0.977399 P\n0.094624 0.605141 0.487618 P\n0.324993 0.324993 0.161601 P\n0.394860 0.905376 0.512382 P\n0.418931 0.418930 0.365170 P\n0.675008 0.675007 0.838398 P\n0.605142 0.094624 0.487618 P\n0.581071 0.581070 0.634829 P\n0.640033 0.162342 0.022600 P\n0.905377 0.394859 0.512382 P\n0.837659 0.359968 0.977399 P\n0.162343 0.640032 0.022600 P\n",
"nsites": 16,
"nelements": 2,
"elements": [
"Sr",
"P"
],
"chemical_system": "P-Sr",
"density": 3.3412047213671223,
"density_atomic": 0.04457973152357594,
"volume": 358.90750018398876,
"volume_molar": 13.508696787048164,
"formula_full": "Sr4 P12",
"formula_reduced": "SrP3",
"formula_anonymous": "AB3",
"energy_above_hull": 1.9033982025000005,
"spacegroup": 12
},
{
"id": "jvasp-29366",
"created_at": "2022-09-04T14:37:59.473695Z",
"updated_at": "2022-09-04T14:37:59.473715Z",
"structure_string": "V8 O20\n1.0\n11.735801 0.000000 0.000000\n0.000000 8.581358 0.000000\n0.000000 -0.000000 3.563978\nV O\n8 20\ndirect\n0.852165 0.944629 0.600048 V\n0.647835 0.555371 0.099956 V\n0.647835 0.055371 0.100048 V\n0.352165 0.555371 0.099956 V\n0.352165 0.055371 0.100048 V\n0.147835 0.944629 0.600048 V\n0.147835 0.444629 0.599957 V\n0.852166 0.444629 0.599957 V\n0.681808 0.502062 0.599955 O\n0.853913 0.256939 0.599969 O\n0.818192 0.497939 0.099955 O\n0.818193 0.997940 0.100048 O\n0.681807 0.002060 0.600048 O\n0.853913 0.756937 0.600032 O\n0.000000 0.996280 0.600066 O\n0.500000 0.003720 0.100066 O\n0.500000 0.503717 0.099932 O\n0.353913 0.243064 0.100031 O\n0.353913 0.743061 0.099969 O\n0.318192 0.502062 0.599955 O\n0.318193 0.002060 0.600048 O\n0.181808 0.497939 0.099955 O\n0.181807 0.997940 0.100048 O\n0.146087 0.756937 0.600032 O\n0.146088 0.256939 0.599969 O\n0.000000 0.496283 0.599932 O\n0.646087 0.243064 0.100031 O\n0.646088 0.743061 0.099969 O\n",
"nsites": 28,
"nelements": 2,
"elements": [
"V",
"O"
],
"chemical_system": "O-V",
"density": 3.365815163772183,
"density_atomic": 0.0780107152340458,
"volume": 358.925051718794,
"volume_molar": 7.719632799074491,
"formula_full": "V8 O20",
"formula_reduced": "V2O5",
"formula_anonymous": "A2B5",
"energy_above_hull": 3.0429222714285715,
"spacegroup": 59
},
{
"id": "jvasp-32186",
"created_at": "2022-09-04T14:38:03.987646Z",
"updated_at": "2022-09-04T14:38:03.987669Z",
"structure_string": "Co2 H18 C6 N12\n1.0\n7.113669 0.002346 -0.952823\n-1.089265 7.029779 -0.952823\n0.002010 0.002346 7.177197\nCo H C N\n2 18 6 12\ndirect\n0.000000 0.000000 0.000000 Co\n0.500001 0.500001 0.500001 Co\n0.592533 0.265369 0.238305 H\n0.199310 0.447710 0.656865 H\n0.734632 0.761696 0.407468 H\n0.407468 0.734632 0.761696 H\n0.761696 0.407468 0.734632 H\n0.265369 0.238305 0.592533 H\n0.552291 0.343136 0.800691 H\n0.238305 0.592533 0.265369 H\n0.447710 0.656865 0.199311 H\n0.567438 0.848400 0.655453 H\n0.655452 0.567438 0.848400 H\n0.151602 0.344549 0.432564 H\n0.432563 0.151602 0.344549 H\n0.344549 0.432564 0.151602 H\n0.800691 0.552291 0.343136 H\n0.343136 0.800691 0.552291 H\n0.656865 0.199311 0.447710 H\n0.848399 0.655452 0.567438 H\n0.235940 0.114072 0.950919 C\n0.885929 0.049082 0.764061 C\n0.950919 0.235941 0.114072 C\n0.114072 0.950919 0.235941 C\n0.049082 0.764061 0.885929 C\n0.764061 0.885929 0.049082 C\n0.448884 0.745143 0.631081 N\n0.745143 0.631081 0.448885 N\n0.631081 0.448885 0.745143 N\n0.811676 0.078038 0.617504 N\n0.078038 0.617504 0.811677 N\n0.617504 0.811677 0.078038 N\n0.368920 0.551117 0.254859 N\n0.921963 0.382498 0.188325 N\n0.382497 0.188325 0.921964 N\n0.254858 0.368920 0.551117 N\n0.188325 0.921963 0.382498 N\n0.551117 0.254859 0.368920 N\n",
"nsites": 38,
"nelements": 4,
"elements": [
"Co",
"H",
"C",
"N"
],
"chemical_system": "C-Co-H-N",
"density": 1.7400583999455963,
"density_atomic": 0.10586020799601241,
"volume": 358.9639650191449,
"volume_molar": 5.688767171350017,
"formula_full": "Co2 H18 C6 N12",
"formula_reduced": "CoH9(CN2)3",
"formula_anonymous": "AB3C6D9",
"energy_above_hull": 5.00114107368421,
"spacegroup": 148
},
{
"id": "jvasp-106463",
"created_at": "2022-09-04T14:36:49.872471Z",
"updated_at": "2022-09-04T14:36:49.872503Z",
"structure_string": "Rb3 Y1 Cl6\n1.0\n6.908673 -0.000000 3.988724\n2.302891 6.513559 3.988724\n-0.000000 -0.000000 7.977448\nRb Y Cl\n3 1 6\ndirect\n0.750000 0.750000 0.750000 Rb\n0.250000 0.250000 0.250000 Rb\n0.500000 0.500000 0.500000 Rb\n0.000000 0.000000 0.000000 Y\n0.768244 0.231755 0.231755 Cl\n0.231755 0.231755 0.768244 Cl\n0.231755 0.768244 0.768243 Cl\n0.231755 0.768245 0.231755 Cl\n0.768243 0.231755 0.768244 Cl\n0.768243 0.768244 0.231755 Cl\n",
"nsites": 10,
"nelements": 3,
"elements": [
"Rb",
"Y",
"Cl"
],
"chemical_system": "Cl-Rb-Y",
"density": 2.5812349340564333,
"density_atomic": 0.027856274246264905,
"volume": 358.98555246816056,
"volume_molar": 21.618615277696282,
"formula_full": "Rb3 Y1 Cl6",
"formula_reduced": "Rb3YCl6",
"formula_anonymous": "AB3C6",
"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-30106",
"created_at": "2022-09-04T14:38:06.624863Z",
"updated_at": "2022-09-04T14:38:06.624882Z",
"structure_string": "U2 B8 H32\n1.0\n3.966353 3.890931 -0.000000\n-3.966353 3.890931 -0.000000\n0.000000 0.000000 11.631742\nU B H\n2 8 32\ndirect\n0.304816 0.304816 0.250000 U\n0.695184 0.695184 0.750000 U\n0.382333 0.809988 0.250000 B\n0.190012 0.617667 0.750000 B\n0.617667 0.190012 0.750000 B\n0.809988 0.382333 0.250000 B\n0.234387 0.234387 0.038942 B\n0.765613 0.765613 0.961058 B\n0.234387 0.234387 0.461058 B\n0.765613 0.765613 0.538942 B\n0.893373 0.893373 0.896654 H\n0.106627 0.106627 0.396654 H\n0.893373 0.893373 0.603346 H\n0.444763 0.192315 0.070396 H\n0.807685 0.555236 0.929604 H\n0.444763 0.192315 0.429604 H\n0.192315 0.444763 0.429604 H\n0.555236 0.807685 0.929604 H\n0.192315 0.444763 0.070396 H\n0.555236 0.807685 0.570396 H\n0.106627 0.106627 0.103346 H\n0.801686 0.801686 0.061107 H\n0.198313 0.198313 0.938893 H\n0.807685 0.555236 0.570396 H\n0.688592 0.394232 0.161878 H\n0.394232 0.688592 0.161878 H\n0.688592 0.394232 0.338122 H\n0.605768 0.311408 0.661878 H\n0.311408 0.605768 0.838121 H\n0.801686 0.801686 0.438893 H\n0.311408 0.605768 0.661878 H\n0.394232 0.688592 0.338122 H\n0.909112 0.184254 0.250000 H\n0.815745 0.090887 0.750000 H\n0.090887 0.815745 0.750000 H\n0.184254 0.909112 0.250000 H\n0.959219 0.550365 0.250000 H\n0.449634 0.040781 0.750000 H\n0.040781 0.449634 0.750000 H\n0.550365 0.959219 0.250000 H\n0.605768 0.311408 0.838121 H\n0.198313 0.198313 0.561107 H\n",
"nsites": 42,
"nelements": 3,
"elements": [
"U",
"B",
"H"
],
"chemical_system": "B-H-U",
"density": 2.7510617300183693,
"density_atomic": 0.11698485512531044,
"volume": 359.02083184195885,
"volume_molar": 5.147795202677538,
"formula_full": "U2 B8 H32",
"formula_reduced": "U(BH4)4",
"formula_anonymous": "AB4C16",
"energy_above_hull": 3.9186374444444447,
"spacegroup": 63
},
{
"id": "jvasp-86095",
"created_at": "2022-09-04T14:35:53.815268Z",
"updated_at": "2022-09-04T14:35:53.815284Z",
"structure_string": "Rb2 Hg2 Pd1 Cl8\n1.0\n6.368219 0.039202 1.932702\n2.754581 5.741780 1.932702\n-0.036506 -0.023132 9.833210\nRb Hg Pd Cl\n2 2 1 8\ndirect\n0.397298 0.397299 0.829108 Rb\n0.602701 0.602701 0.170891 Rb\n0.866065 0.866065 0.400907 Hg\n0.133934 0.133935 0.599093 Hg\n0.000000 0.000000 0.000000 Pd\n0.085096 0.085097 0.305975 Cl\n0.106689 0.623952 0.134375 Cl\n0.647877 0.647877 0.503505 Cl\n0.376047 0.893311 0.865624 Cl\n0.352122 0.352123 0.496495 Cl\n0.623952 0.106689 0.134375 Cl\n0.893310 0.376048 0.865624 Cl\n0.914903 0.914904 0.694024 Cl\n",
"nsites": 13,
"nelements": 4,
"elements": [
"Rb",
"Hg",
"Pd",
"Cl"
],
"chemical_system": "Cl-Hg-Pd-Rb",
"density": 4.44977681544209,
"density_atomic": 0.03620640177073382,
"volume": 359.0525256367258,
"volume_molar": 16.63280653552209,
"formula_full": "Rb2 Hg2 Pd1 Cl8",
"formula_reduced": "Rb2Hg2PdCl8",
"formula_anonymous": "AB2C2D8",
"energy_above_hull": 4.615384615429263e-06,
"spacegroup": 12
},
{
"id": "jvasp-99679",
"created_at": "2022-09-04T14:36:35.119415Z",
"updated_at": "2022-09-04T14:36:35.119436Z",
"structure_string": "K2 Rb1 Dy1 Cl6\n1.0\n6.909239 -0.000000 3.989051\n2.303080 6.514092 3.989051\n-0.000000 -0.000000 7.978101\nK Rb Dy Cl\n2 1 1 6\ndirect\n0.750000 0.750000 0.750000 K\n0.250000 0.250000 0.250000 K\n0.500000 0.500000 0.500000 Rb\n0.000000 0.000000 0.000000 Dy\n0.768242 0.231758 0.231758 Cl\n0.231758 0.231758 0.768242 Cl\n0.231758 0.768242 0.768242 Cl\n0.231758 0.768242 0.231758 Cl\n0.768242 0.231758 0.768242 Cl\n0.768243 0.768242 0.231758 Cl\n",
"nsites": 10,
"nelements": 4,
"elements": [
"K",
"Rb",
"Dy",
"Cl"
],
"chemical_system": "Cl-Dy-K-Rb",
"density": 2.492065560550936,
"density_atomic": 0.02784943355725171,
"volume": 359.0737305102603,
"volume_molar": 21.623925483510938,
"formula_full": "K2 Rb1 Dy1 Cl6",
"formula_reduced": "K2RbDyCl6",
"formula_anonymous": "ABC2D6",
"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-86695",
"created_at": "2022-09-04T14:35:41.048650Z",
"updated_at": "2022-09-04T14:35:41.048673Z",
"structure_string": "Rb2 Hg2 Pd1 Cl8\n1.0\n6.368097 0.039047 1.932409\n2.754388 5.741736 1.932409\n-0.037039 -0.023470 9.834079\nRb Hg Pd Cl\n2 2 1 8\ndirect\n0.397295 0.397295 0.829109 Rb\n0.602705 0.602706 0.170891 Rb\n0.866074 0.866075 0.400908 Hg\n0.133926 0.133926 0.599092 Hg\n0.000000 0.000000 0.000000 Pd\n0.085111 0.085111 0.305976 Cl\n0.106719 0.623961 0.134386 Cl\n0.647880 0.647881 0.503489 Cl\n0.376039 0.893282 0.865614 Cl\n0.352119 0.352120 0.496511 Cl\n0.623961 0.106720 0.134386 Cl\n0.893281 0.376040 0.865614 Cl\n0.914889 0.914890 0.694024 Cl\n",
"nsites": 13,
"nelements": 4,
"elements": [
"Rb",
"Hg",
"Pd",
"Cl"
],
"chemical_system": "Cl-Hg-Pd-Rb",
"density": 4.449349676303782,
"density_atomic": 0.03620292627704166,
"volume": 359.08699480583266,
"volume_molar": 16.634403290816255,
"formula_full": "Rb2 Hg2 Pd1 Cl8",
"formula_reduced": "Rb2Hg2PdCl8",
"formula_anonymous": "AB2C2D8",
"energy_above_hull": 0.0,
"spacegroup": 12
},
{
"id": "jvasp-104011",
"created_at": "2022-09-04T14:36:51.634367Z",
"updated_at": "2022-09-04T14:36:51.634387Z",
"structure_string": "Sn2 H24 C12 F4\n1.0\n4.421855 -0.064144 0.274256\n1.428171 4.195667 0.329308\n-0.011557 -0.140125 19.251801\nSn H C F\n2 24 12 4\ndirect\n0.314439 0.714661 0.536515 Sn\n0.212519 0.443385 0.059705 Sn\n0.830859 -0.012115 0.902186 H\n0.490517 0.962416 0.955348 H\n0.384142 0.598007 0.876695 H\n0.750371 0.557058 0.829965 H\n0.077571 0.740294 0.367266 H\n0.695086 0.394127 0.442199 H\n0.573967 0.798295 0.411847 H\n0.286716 0.256684 0.292383 H\n0.650113 0.159636 0.334181 H\n0.355534 0.770504 0.245674 H\n0.717484 0.682558 0.287713 H\n0.150606 0.364179 0.410857 H\n0.543756 0.128699 0.784995 H\n0.177244 0.163069 0.830430 H\n0.721678 0.506765 0.725382 H\n0.669398 0.844334 0.669180 H\n0.649986 0.300395 0.621558 H\n0.590048 0.274589 0.177458 H\n0.254732 0.409964 0.657184 H\n0.947144 0.201011 0.219125 H\n0.961953 0.757604 0.171708 H\n0.641376 0.782212 0.120328 H\n0.132547 0.704744 0.761196 H\n0.104446 0.057887 0.711106 H\n0.444533 0.360831 0.317643 C\n0.548358 0.728165 0.856402 C\n0.487518 0.602141 0.431751 C\n0.267790 0.523665 0.382968 C\n0.674708 0.843291 0.917066 C\n0.560719 0.572901 0.263746 C\n0.740529 0.395561 0.200473 C\n0.545131 0.682480 0.693294 C\n0.269682 0.863671 0.741475 C\n0.846369 0.610903 0.145912 C\n0.448720 0.502063 0.638318 C\n0.381163 -0.005745 0.803825 C\n0.083602 0.990617 0.040777 F\n0.196029 0.200627 0.539089 F\n0.822958 0.824944 0.536970 F\n0.874119 0.558916 0.953705 F\n",
"nsites": 42,
"nelements": 4,
"elements": [
"Sn",
"H",
"C",
"F"
],
"chemical_system": "C-F-H-Sn",
"density": 2.2276258669314903,
"density_atomic": 0.11695975035143108,
"volume": 359.09789370960385,
"volume_molar": 5.1489001489017925,
"formula_full": "Sn2 H24 C12 F4",
"formula_reduced": "SnH12(C3F)2",
"formula_anonymous": "AB2C6D12",
"energy_above_hull": 4.037994393571429,
"spacegroup": 1
},
{
"id": "jvasp-36964",
"created_at": "2022-09-04T14:38:03.896798Z",
"updated_at": "2022-09-04T14:38:03.896830Z",
"structure_string": "Rb2 Pb2 Br6\n1.0\n0.000000 4.441303 0.003186\n11.329881 0.000000 0.000000\n0.000000 -2.215194 -7.138474\nRb Pb Br\n2 2 6\ndirect\n0.750105 0.009551 0.500204 Rb\n0.249895 0.509551 0.499795 Rb\n0.999987 0.759544 -0.000014 Pb\n0.000012 0.259544 0.000013 Pb\n0.642164 0.707683 0.284354 Br\n0.357835 0.207683 0.715645 Br\n0.642197 0.311382 0.284396 Br\n0.357802 0.811382 0.715603 Br\n0.068663 0.009541 0.137277 Br\n0.931336 0.509541 0.862721 Br\n",
"nsites": 10,
"nelements": 3,
"elements": [
"Rb",
"Pb",
"Br"
],
"chemical_system": "Br-Pb-Rb",
"density": 4.92329905311273,
"density_atomic": 0.0278455342517368,
"volume": 359.12401283434787,
"volume_molar": 21.626953555844896,
"formula_full": "Rb2 Pb2 Br6",
"formula_reduced": "RbPbBr3",
"formula_anonymous": "ABC3",
"energy_above_hull": 0.0,
"spacegroup": 63
},
{
"id": "jvasp-29210",
"created_at": "2022-09-04T14:37:41.086755Z",
"updated_at": "2022-09-04T14:37:41.086780Z",
"structure_string": "Te2 Mo2 W2 Se6\n1.0\n3.386453 0.000001 -0.000013\n-1.693226 2.932755 -0.000006\n-0.000138 -0.000177 36.159863\nTe Mo W Se\n2 2 2 6\ndirect\n0.666661 0.333374 0.416165 Te\n0.666666 0.333364 0.520874 Te\n0.333333 0.666635 0.096707 Mo\n0.666616 0.333305 0.277163 Mo\n0.333331 0.666703 0.468522 W\n0.666717 0.333362 0.660521 W\n0.333289 0.666643 0.322923 Se\n0.333389 0.666697 0.706415 Se\n0.666654 0.333285 0.051025 Se\n0.666676 0.333315 0.142449 Se\n0.333278 0.666636 0.231435 Se\n0.333374 0.666683 0.614550 Se\n",
"nsites": 12,
"nelements": 4,
"elements": [
"Te",
"Mo",
"W",
"Se"
],
"chemical_system": "Mo-Se-Te-W",
"density": 5.957891289496935,
"density_atomic": 0.03341439169639049,
"volume": 359.1266933432241,
"volume_molar": 18.022595816552087,
"formula_full": "Te2 Mo2 W2 Se6",
"formula_reduced": "TeMoWSe3",
"formula_anonymous": "ABCD3",
"energy_above_hull": 3.447865627777778,
"spacegroup": 156
},
{
"id": "jvasp-116796",
"created_at": "2022-09-04T14:38:43.680083Z",
"updated_at": "2022-09-04T14:38:43.680104Z",
"structure_string": "Mn6 Pb6 O18\n1.0\n5.522675 0.000000 0.181267\n2.761337 4.782095 0.090633\n-0.050725 0.000000 13.596629\nMn Pb O\n6 6 18\ndirect\n0.000000 0.000000 0.000000 Mn\n-0.000000 -0.000000 0.500000 Mn\n0.672618 0.674137 0.844907 Mn\n0.653244 0.674137 0.655093 Mn\n0.327380 0.325864 0.155093 Mn\n0.346754 0.325864 0.344907 Mn\n0.329222 0.341824 0.591492 Pb\n0.328951 0.341824 0.908508 Pb\n0.670776 0.658177 0.408508 Pb\n0.990883 0.018231 0.750000 Pb\n0.009116 0.981770 0.250000 Pb\n0.671047 0.658177 0.091492 Pb\n0.788857 0.328889 0.582090 O\n0.206766 0.167147 0.438500 O\n0.626088 0.167147 0.061500 O\n0.288695 0.828257 0.595152 O\n0.883045 0.828257 0.904848 O\n0.711303 0.171744 0.404848 O\n0.116953 0.171744 0.095152 O\n0.882251 0.328889 0.917910 O\n0.039749 0.473303 0.261214 O\n0.117747 0.671112 0.082090 O\n0.513050 0.526698 0.761214 O\n0.960249 0.526698 0.738786 O\n0.486948 0.473303 0.238786 O\n0.373911 0.832854 0.938500 O\n0.513282 0.973434 0.750000 O\n0.486716 0.026567 0.250000 O\n0.211141 0.671112 0.417910 O\n0.793232 0.832854 0.561500 O\n",
"nsites": 30,
"nelements": 3,
"elements": [
"Mn",
"Pb",
"O"
],
"chemical_system": "Mn-O-Pb",
"density": 8.604007147537411,
"density_atomic": 0.08353512850525156,
"volume": 359.13035074955326,
"volume_molar": 7.20911174467327,
"formula_full": "Mn6 Pb6 O18",
"formula_reduced": "MnPbO3",
"formula_anonymous": "ABC3",
"energy_above_hull": 2.174245712275862,
"spacegroup": 15
}
]
}