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=density_atomic&page=1243",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=density_atomic&page=1241",
"results": [
{
"id": "jvasp-2148",
"created_at": "2022-09-04T14:36:03.281498Z",
"updated_at": "2022-09-04T14:36:03.281523Z",
"structure_string": "Na6 P2\n1.0\n2.473338 -4.283949 0.000000\n2.473338 4.283949 0.000000\n0.000000 0.000000 8.808096\nNa P\n6 2\ndirect\n0.000000 0.000000 0.750000 Na\n0.000000 0.000000 0.250000 Na\n0.666667 0.333333 0.420165 Na\n0.333333 0.666667 0.920165 Na\n0.333333 0.666667 0.579835 Na\n0.666667 0.333333 0.079835 Na\n0.666667 0.333333 0.750000 P\n0.333333 0.666667 0.250000 P\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Na",
"P"
],
"chemical_system": "Na-P",
"density": 1.7782465761832058,
"density_atomic": 0.04285980492137375,
"volume": 186.65507261817893,
"volume_molar": 14.050789010933691,
"formula_full": "Na6 P2",
"formula_reduced": "Na3P",
"formula_anonymous": "AB3",
"energy_above_hull": 0.104610625,
"spacegroup": 194
},
{
"id": "jvasp-108742",
"created_at": "2022-09-04T14:37:56.147297Z",
"updated_at": "2022-09-04T14:37:56.147328Z",
"structure_string": "Pt2 Cl4\n1.0\n5.871614 -0.184908 1.711870\n4.954035 3.157147 1.711870\n0.097206 0.026689 7.226751\nPt Cl\n2 4\ndirect\n0.500038 0.500038 0.750037 Pt\n0.499962 0.499963 0.249963 Pt\n0.860003 0.860004 0.820616 Cl\n0.139997 0.139997 0.179383 Cl\n0.859922 0.859923 0.320623 Cl\n0.140078 0.140078 0.679377 Cl\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Pt",
"Cl"
],
"chemical_system": "Cl-Pt",
"density": 6.310343486484317,
"density_atomic": 0.04286075799769576,
"volume": 139.9881915369431,
"volume_molar": 14.050476569555201,
"formula_full": "Pt2 Cl4",
"formula_reduced": "PtCl2",
"formula_anonymous": "AB2",
"energy_above_hull": 0.7209265116666665,
"spacegroup": 71
},
{
"id": "jvasp-35744",
"created_at": "2022-09-04T14:37:27.721192Z",
"updated_at": "2022-09-04T14:37:27.721227Z",
"structure_string": "Ba2 N1 F1\n1.0\n-2.009232 -3.480092 -0.000000\n-4.018465 0.000000 0.000000\n-2.009232 -1.160030 -6.673126\nBa N F\n2 1 1\ndirect\n0.757303 0.757302 0.728089 Ba\n0.242696 0.242696 0.271911 Ba\n0.500000 0.499999 0.500000 N\n0.000000 0.000000 0.000000 F\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ba",
"N",
"F"
],
"chemical_system": "Ba-F-N",
"density": 5.474426469828363,
"density_atomic": 0.042862722344396725,
"volume": 93.32118403167418,
"volume_molar": 14.049832653215155,
"formula_full": "Ba2 N1 F1",
"formula_reduced": "Ba2NF",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.6472613681249999,
"spacegroup": 166
},
{
"id": "jvasp-91496",
"created_at": "2022-09-04T14:35:40.746004Z",
"updated_at": "2022-09-04T14:35:40.746022Z",
"structure_string": "Nb4 Tl2 P2 S20\n1.0\n6.774924 0.000000 -1.731747\n0.000000 7.413830 0.000000\n0.034494 0.000000 12.996302\nNb Tl P S\n4 2 2 20\ndirect\n0.841311 0.443254 0.158960 Nb\n0.341311 0.556746 0.658960 Nb\n0.544854 0.435042 0.870286 Nb\n0.044855 0.564958 0.370286 Nb\n0.870043 0.993208 0.614250 Tl\n0.370043 0.006792 0.114250 Tl\n0.824433 0.092999 0.989859 P\n0.324433 0.907001 0.489859 P\n0.470819 0.450122 0.054693 S\n0.533060 0.091195 0.902238 S\n0.693203 0.636552 0.281589 S\n0.343262 0.912025 0.651706 S\n0.634722 0.666611 0.023543 S\n0.703754 0.611535 0.748399 S\n0.736123 0.372449 0.325239 S\n0.193203 0.363448 0.781589 S\n0.915329 0.359137 0.972917 S\n0.135745 0.648876 0.196910 S\n0.843262 0.087975 0.151706 S\n0.635745 0.351124 0.696909 S\n0.970818 0.549878 0.554693 S\n0.236123 0.627551 0.825238 S\n0.203755 0.388465 0.248400 S\n0.134722 0.333389 0.523543 S\n0.415330 0.640863 0.472917 S\n0.033061 0.908805 0.402238 S\n0.483763 0.094827 0.440087 S\n0.983762 0.905173 0.940087 S\n",
"nsites": 28,
"nelements": 4,
"elements": [
"Nb",
"Tl",
"P",
"S"
],
"chemical_system": "Nb-P-S-Tl",
"density": 3.7715176419305374,
"density_atomic": 0.04286439002290391,
"volume": 653.2228729964113,
"volume_molar": 14.049286031557115,
"formula_full": "Nb4 Tl2 P2 S20",
"formula_reduced": "Nb2TlPS10",
"formula_anonymous": "ABC2D10",
"energy_above_hull": 2.801791921428571,
"spacegroup": 7
},
{
"id": "jvasp-26361",
"created_at": "2022-09-04T14:37:44.612598Z",
"updated_at": "2022-09-04T14:37:44.612613Z",
"structure_string": "Sr2 Cu1 I2 O2\n1.0\n3.975406 0.000000 -0.791459\n-0.157571 3.972282 -0.791459\n-0.007158 -0.007447 10.343775\nSr Cu I O\n2 1 2 2\ndirect\n0.416184 0.416183 0.832367 Sr\n0.583812 0.583811 0.167623 Sr\n0.000015 0.000015 0.000030 Cu\n0.170967 0.170967 0.341933 I\n0.829023 0.829022 0.658044 I\n0.500001 0.000001 0.000000 O\n0.000001 0.500000 0.000000 O\n",
"nsites": 7,
"nelements": 4,
"elements": [
"Sr",
"Cu",
"I",
"O"
],
"chemical_system": "Cu-I-O-Sr",
"density": 5.334530391556715,
"density_atomic": 0.04286689551859309,
"volume": 163.2961733131297,
"volume_molar": 14.048464875157466,
"formula_full": "Sr2 Cu1 I2 O2",
"formula_reduced": "Sr2Cu(IO)2",
"formula_anonymous": "AB2C2D2",
"energy_above_hull": 0.1551360885714288,
"spacegroup": 139
},
{
"id": "jvasp-56296",
"created_at": "2022-09-04T14:37:48.906225Z",
"updated_at": "2022-09-04T14:37:48.906247Z",
"structure_string": "Er2 Ag2 Sn2\n1.0\n2.346424 -4.064125 0.000000\n2.346424 4.064125 0.000000\n-0.000000 0.000000 7.338294\nEr Ag Sn\n2 2 2\ndirect\n0.000000 0.000000 0.755058 Er\n0.000000 0.000000 0.255058 Er\n0.333332 0.666666 0.937663 Ag\n0.666666 0.333332 0.437664 Ag\n0.333332 0.666666 0.534278 Sn\n0.666666 0.333332 0.034278 Sn\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Er",
"Ag",
"Sn"
],
"chemical_system": "Ag-Er-Sn",
"density": 9.345384538910206,
"density_atomic": 0.04286991262056544,
"volume": 139.95829786510214,
"volume_molar": 14.047476171227544,
"formula_full": "Er2 Ag2 Sn2",
"formula_reduced": "ErAgSn",
"formula_anonymous": "ABC",
"energy_above_hull": 0.25563632,
"spacegroup": 186
},
{
"id": "jvasp-2991",
"created_at": "2022-09-04T14:36:57.709489Z",
"updated_at": "2022-09-04T14:36:57.709515Z",
"structure_string": "Ca1 Mg2 As2\n1.0\n2.177059 -3.770776 0.000000\n2.177059 3.770776 0.000000\n0.000000 0.000000 7.103615\nCa Mg As\n1 2 2\ndirect\n0.000000 0.000000 0.000000 Ca\n0.666668 0.333333 0.634407 Mg\n0.333333 0.666668 0.365592 Mg\n0.333333 0.666668 0.751550 As\n0.666668 0.333333 0.248449 As\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Ca",
"Mg",
"As"
],
"chemical_system": "As-Ca-Mg",
"density": 3.3961271836561773,
"density_atomic": 0.04287060968524795,
"volume": 116.63001848374766,
"volume_molar": 14.047247763010603,
"formula_full": "Ca1 Mg2 As2",
"formula_reduced": "Ca(MgAs)2",
"formula_anonymous": "AB2C2",
"energy_above_hull": 0.3237344039999997,
"spacegroup": 164
},
{
"id": "jvasp-17782",
"created_at": "2022-09-04T14:38:08.644784Z",
"updated_at": "2022-09-04T14:38:08.644807Z",
"structure_string": "Tb1 In5 Rh1\n1.0\n4.659527 0.000000 -0.000000\n0.000000 4.659527 -0.000000\n0.000000 -0.000000 7.520581\nTb In Rh\n1 5 1\ndirect\n0.000000 0.000000 0.000000 Tb\n0.500000 0.500000 0.000000 In\n0.500000 0.000000 0.699377 In\n0.000000 0.500000 0.300622 In\n0.500000 0.000000 0.300622 In\n0.000000 0.500000 0.699377 In\n0.000000 0.000000 0.500000 Rh\n",
"nsites": 7,
"nelements": 3,
"elements": [
"Tb",
"In",
"Rh"
],
"chemical_system": "In-Rh-Tb",
"density": 8.501179706291333,
"density_atomic": 0.042870937582815065,
"volume": 163.2807770177149,
"volume_molar": 14.047140322897889,
"formula_full": "Tb1 In5 Rh1",
"formula_reduced": "TbIn5Rh",
"formula_anonymous": "ABC5",
"energy_above_hull": 0.2455558928571427,
"spacegroup": 123
},
{
"id": "jvasp-110883",
"created_at": "2022-09-04T14:38:48.522901Z",
"updated_at": "2022-09-04T14:38:48.522918Z",
"structure_string": "Y2 Ag1 Au1\n1.0\n4.408909 -0.000000 2.545485\n1.469636 4.156759 2.545485\n-0.000000 -0.000000 5.090969\nY Ag Au\n2 1 1\ndirect\n0.250000 0.250000 0.249999 Y\n0.750001 0.750000 0.749998 Y\n0.500001 0.500000 0.499999 Ag\n0.000000 0.000000 0.000000 Au\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Y",
"Ag",
"Au"
],
"chemical_system": "Ag-Au-Y",
"density": 8.589972972496176,
"density_atomic": 0.04287198163079848,
"volume": 93.30102896681758,
"volume_molar": 14.046798237275322,
"formula_full": "Y2 Ag1 Au1",
"formula_reduced": "Y2AgAu",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.3208239325,
"spacegroup": 225
},
{
"id": "jvasp-102570",
"created_at": "2022-09-04T14:36:51.017850Z",
"updated_at": "2022-09-04T14:36:51.017874Z",
"structure_string": "Yb1 Sm1 Au2\n1.0\n4.408822 -0.000000 2.545435\n1.469607 4.156677 2.545435\n-0.000000 -0.000000 5.090869\nYb Sm Au\n1 1 2\ndirect\n0.000000 0.000000 0.000000 Yb\n0.500000 0.500000 0.499999 Sm\n0.250000 0.250000 0.250000 Au\n0.750000 0.750000 0.749999 Au\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Yb",
"Sm",
"Au"
],
"chemical_system": "Au-Sm-Yb",
"density": 12.767598767842367,
"density_atomic": 0.04287451556362938,
"volume": 93.29551476945936,
"volume_molar": 14.04596805545858,
"formula_full": "Yb1 Sm1 Au2",
"formula_reduced": "YbSmAu2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.14926367875,
"spacegroup": 225
},
{
"id": "jvasp-10088",
"created_at": "2022-09-04T14:36:52.181030Z",
"updated_at": "2022-09-04T14:36:52.181050Z",
"structure_string": "K1 Cr1 P2 S7\n1.0\n6.227738 0.017499 -0.561267\n-0.643143 6.377786 -0.742095\n0.023156 0.021007 6.452869\nK Cr P S\n1 1 2 7\ndirect\n0.500001 0.898561 0.101440 K\n0.000001 0.499930 0.500071 Cr\n0.919776 0.951530 0.643037 P\n0.080226 0.356964 0.048472 P\n0.000001 0.021941 0.978059 S\n0.233168 0.474201 0.816306 S\n0.714140 0.687245 0.633179 S\n0.285861 0.366822 0.312757 S\n0.819107 0.491538 0.148020 S\n0.180894 0.851981 0.508463 S\n0.766833 0.183695 0.525800 S\n",
"nsites": 11,
"nelements": 4,
"elements": [
"K",
"Cr",
"P",
"S"
],
"chemical_system": "Cr-K-P-S",
"density": 2.4432575829746446,
"density_atomic": 0.04287453529280931,
"volume": 256.56254755593494,
"volume_molar": 14.045961592054855,
"formula_full": "K1 Cr1 P2 S7",
"formula_reduced": "KCrP2S7",
"formula_anonymous": "ABC2D7",
"energy_above_hull": 2.4840614909090912,
"spacegroup": 5
},
{
"id": "jvasp-69355",
"created_at": "2022-09-04T14:35:46.503300Z",
"updated_at": "2022-09-04T14:35:46.503331Z",
"structure_string": "Ba1 Hg1 W2\n1.0\n4.220661 0.000000 -0.000000\n-0.000000 4.220661 0.000000\n-0.000000 -0.000000 5.236815\nBa Hg W\n1 1 2\ndirect\n0.500000 0.500000 0.500000 Ba\n0.000000 0.000000 0.500000 Hg\n0.500000 0.000000 0.000000 W\n0.000000 0.500000 0.000000 W\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ba",
"Hg",
"W"
],
"chemical_system": "Ba-Hg-W",
"density": 12.559653219410631,
"density_atomic": 0.04287773310272928,
"volume": 93.28851388706904,
"volume_molar": 14.044914047978613,
"formula_full": "Ba1 Hg1 W2",
"formula_reduced": "BaHgW2",
"formula_anonymous": "ABC2",
"energy_above_hull": 3.9165626425,
"spacegroup": 123
}
]
}