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_molar&page=3403",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=volume_molar&page=3401",
"results": [
{
"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-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-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-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-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-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-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-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-59051",
"created_at": "2022-09-04T14:38:36.185681Z",
"updated_at": "2022-09-04T14:38:36.185700Z",
"structure_string": "As4 Cl12 O4\n1.0\n0.000000 8.100262 -0.004705\n6.096153 0.000000 0.000000\n0.000000 -3.855589 -9.447989\nAs Cl O\n4 12 4\ndirect\n0.661749 0.560725 0.987420 As\n0.338250 0.060725 0.512580 As\n0.338250 0.439275 0.012580 As\n0.661749 0.939274 0.487419 As\n0.797196 0.879585 0.987503 Cl\n0.202804 0.379585 0.512497 Cl\n0.202804 0.120414 0.012497 Cl\n0.797196 0.620414 0.487503 Cl\n0.885887 0.428582 0.163456 Cl\n0.114112 0.928582 0.336543 Cl\n0.114112 0.571417 0.836543 Cl\n0.885887 0.071418 0.663456 Cl\n0.655709 0.457263 0.783328 Cl\n0.344291 0.957263 0.716671 Cl\n0.344291 0.542736 0.216671 Cl\n0.655709 0.042736 0.283328 Cl\n0.478199 0.694906 0.005633 O\n0.521801 0.194907 0.494367 O\n0.521801 0.305093 0.994367 O\n0.478198 0.805093 0.505633 O\n",
"nsites": 20,
"nelements": 3,
"elements": [
"As",
"Cl",
"O"
],
"chemical_system": "As-Cl-O",
"density": 2.807985843166095,
"density_atomic": 0.04285808496927533,
"volume": 466.6564083378402,
"volume_molar": 14.051352887832557,
"formula_full": "As4 Cl12 O4",
"formula_reduced": "AsCl3O",
"formula_anonymous": "ABC3",
"energy_above_hull": 0.9467374904999998,
"spacegroup": 14
},
{
"id": "jvasp-13808",
"created_at": "2022-09-04T14:37:48.816360Z",
"updated_at": "2022-09-04T14:37:48.816381Z",
"structure_string": "As4 Cl12 O4\n1.0\n0.000000 8.100220 -0.004725\n6.096193 0.000000 0.000000\n0.000000 -3.855546 -9.448018\nAs Cl O\n4 12 4\ndirect\n0.661749 0.560723 0.987416 As\n0.338250 0.060723 0.512584 As\n0.338251 0.439276 0.012584 As\n0.661749 0.939276 0.487416 As\n0.797196 0.879585 0.987502 Cl\n0.202803 0.379585 0.512498 Cl\n0.202804 0.120415 0.012498 Cl\n0.797196 0.620415 0.487502 Cl\n0.885888 0.428577 0.163452 Cl\n0.114111 0.928577 0.336547 Cl\n0.114111 0.571422 0.836547 Cl\n0.885888 0.071423 0.663452 Cl\n0.655708 0.457266 0.783326 Cl\n0.344291 0.957266 0.716674 Cl\n0.344292 0.542734 0.216674 Cl\n0.655708 0.042734 0.283326 Cl\n0.478199 0.694906 0.005632 O\n0.521801 0.194907 0.494368 O\n0.521801 0.305093 0.994368 O\n0.478198 0.805093 0.505632 O\n",
"nsites": 20,
"nelements": 3,
"elements": [
"As",
"Cl",
"O"
],
"chemical_system": "As-Cl-O",
"density": 2.8079705366225647,
"density_atomic": 0.04285785134660775,
"volume": 466.65895213113674,
"volume_molar": 14.051429483239037,
"formula_full": "As4 Cl12 O4",
"formula_reduced": "AsCl3O",
"formula_anonymous": "ABC3",
"energy_above_hull": 0.9467374904999998,
"spacegroup": 14
},
{
"id": "jvasp-8760",
"created_at": "2022-09-04T14:37:04.304261Z",
"updated_at": "2022-09-04T14:37:04.304281Z",
"structure_string": "Cu1 Cl4\n1.0\n7.367728 0.000000 -0.000000\n7.367728 6.486871 1.414154\n3.683865 4.991647 3.529227\nCu Cl\n1 4\ndirect\n0.236696 0.500123 0.026362 Cu\n0.120241 0.026034 0.207451 Cl\n0.646464 -0.026576 0.260222 Cl\n0.367750 0.500210 0.252982 Cl\n0.878849 0.500210 0.252982 Cl\n",
"nsites": 5,
"nelements": 2,
"elements": [
"Cu",
"Cl"
],
"chemical_system": "Cl-Cu",
"density": 2.9229256858232295,
"density_atomic": 0.042857521784225576,
"volume": 116.66563515206175,
"volume_molar": 14.051537534810397,
"formula_full": "Cu1 Cl4",
"formula_reduced": "CuCl4",
"formula_anonymous": "AB4",
"energy_above_hull": 0.111781627,
"spacegroup": 42
},
{
"id": "jvasp-26408",
"created_at": "2022-09-04T14:37:40.735780Z",
"updated_at": "2022-09-04T14:37:40.735800Z",
"structure_string": "Sr2 Bi2 I2 O4\n1.0\n0.000000 5.925234 0.000001\n5.817488 0.000000 0.000000\n0.000000 -2.962543 -6.769170\nSr Bi I O\n2 2 2 4\ndirect\n0.594047 0.750000 0.188095 Sr\n0.405953 0.250000 0.811905 Sr\n0.924552 0.750000 0.849105 Bi\n0.075448 0.250000 0.150895 Bi\n0.255031 0.750000 0.510062 I\n0.744969 0.250000 0.489938 I\n0.233281 0.499999 0.000001 O\n0.233281 0.000001 0.000001 O\n0.766719 -0.000001 -0.000001 O\n0.766719 0.500001 -0.000001 O\n",
"nsites": 10,
"nelements": 4,
"elements": [
"Sr",
"Bi",
"I",
"O"
],
"chemical_system": "Bi-I-O-Sr",
"density": 6.483277072995382,
"density_atomic": 0.042857181735935834,
"volume": 233.33312166009694,
"volume_molar": 14.051649026073088,
"formula_full": "Sr2 Bi2 I2 O4",
"formula_reduced": "SrBiIO2",
"formula_anonymous": "ABCD2",
"energy_above_hull": 0.6295847770000002,
"spacegroup": 63
}
]
}