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=4159",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=density_atomic&page=4157",
"results": [
{
"id": "jvasp-46540",
"created_at": "2022-09-04T14:37:27.301382Z",
"updated_at": "2022-09-04T14:37:27.301403Z",
"structure_string": "Mg4 Mn6 O16\n1.0\n2.899860 5.694973 0.000000\n-2.899860 5.694973 0.000000\n0.000000 0.000000 8.341550\nMg Mn O\n4 6 16\ndirect\n0.143663 0.143663 0.607210 Mg\n0.356336 0.356336 0.107210 Mg\n0.643663 0.643663 0.892790 Mg\n0.856336 0.856336 0.392790 Mg\n0.870801 0.370801 0.250000 Mn\n0.500000 0.500000 0.500000 Mn\n0.629199 0.129199 0.750000 Mn\n0.129199 0.629199 0.750000 Mn\n0.370801 0.870801 0.250000 Mn\n0.000000 0.000000 0.000000 Mn\n-0.000380 -0.000380 0.235015 O\n0.883511 0.344982 0.025862 O\n0.655017 0.116489 0.974138 O\n0.500380 0.500380 0.735015 O\n0.725478 0.725478 0.238086 O\n0.499620 0.499620 0.264985 O\n0.774521 0.774521 0.738086 O\n0.116489 0.655017 0.974138 O\n0.274522 0.274522 0.761914 O\n0.000380 0.000380 0.764985 O\n0.344982 0.883511 0.025862 O\n0.616489 0.155017 0.525862 O\n0.383511 0.844982 0.474138 O\n0.155017 0.616489 0.525862 O\n0.225478 0.225478 0.261914 O\n0.844982 0.383511 0.474138 O\n",
"nsites": 26,
"nelements": 3,
"elements": [
"Mg",
"Mn",
"O"
],
"chemical_system": "Mg-Mn-O",
"density": 4.115491900979282,
"density_atomic": 0.09436868299439655,
"volume": 275.51513039070215,
"volume_molar": 6.381503448932932,
"formula_full": "Mg4 Mn6 O16",
"formula_reduced": "Mg2Mn3O8",
"formula_anonymous": "A2B3C8",
"energy_above_hull": 2.695245217241379,
"spacegroup": 64
},
{
"id": "jvasp-101830",
"created_at": "2022-09-04T14:36:38.541923Z",
"updated_at": "2022-09-04T14:36:38.541943Z",
"structure_string": "H14 C16 S2 N2\n1.0\n6.249302 0.082152 -0.229426\n-2.997568 6.024268 -0.374806\n-0.192560 0.132657 9.504110\nH C S N\n14 16 2 2\ndirect\n0.680835 0.337072 0.057473 H\n0.156450 0.131652 0.689601 H\n0.156449 0.131652 0.189601 H\n0.346900 0.250592 0.381679 H\n0.516245 0.649283 0.567989 H\n0.516245 0.649283 0.067989 H\n0.179730 0.560054 0.385583 H\n0.346900 0.250591 0.881679 H\n0.864594 0.234858 0.731864 H\n0.864593 0.234859 0.231864 H\n0.692136 -0.028102 0.793621 H\n0.692135 -0.028102 0.293621 H\n0.680836 0.337072 0.557473 H\n0.179731 0.560055 0.885583 H\n0.792912 0.056485 0.705689 C\n0.011144 0.842967 0.284657 C\n0.011146 0.842967 0.784657 C\n0.384830 0.116415 0.417861 C\n0.384829 0.116416 0.917860 C\n0.573272 0.165997 0.519507 C\n0.573271 0.165998 0.019507 C\n0.792916 0.056484 0.205689 C\n0.292554 0.730480 0.922627 C\n0.237791 0.897047 0.869740 C\n0.619581 -0.001353 0.576654 C\n0.619579 -0.001354 0.076654 C\n0.292555 0.730480 0.422628 C\n0.479483 0.779904 0.524570 C\n0.479482 0.779903 0.024569 C\n0.237789 0.897046 0.369739 C\n0.774016 0.606312 0.802245 S\n0.774017 0.606313 0.302245 S\n-0.001182 0.003691 0.206679 N\n-0.001182 0.003691 0.706678 N\n",
"nsites": 34,
"nelements": 4,
"elements": [
"H",
"C",
"S",
"N"
],
"chemical_system": "C-H-N-S",
"density": 1.3754213229034546,
"density_atomic": 0.0943689806354327,
"volume": 360.2878803083524,
"volume_molar": 6.381483321585089,
"formula_full": "H14 C16 S2 N2",
"formula_reduced": "H7C8SN",
"formula_anonymous": "ABC7D8",
"energy_above_hull": 5.40474725,
"spacegroup": 1
},
{
"id": "jvasp-23330",
"created_at": "2022-09-04T14:37:38.383888Z",
"updated_at": "2022-09-04T14:37:38.383908Z",
"structure_string": "Mn2 B4 W4\n1.0\n5.770463 0.000000 0.000000\n0.000000 5.770463 -0.000000\n0.000000 -0.000000 3.182293\nMn B W\n2 4 4\ndirect\n0.500000 0.500000 0.000000 Mn\n0.000000 0.000000 0.000000 Mn\n0.115056 0.615055 0.000000 B\n0.884944 0.384944 0.000000 B\n0.615055 0.884944 0.000000 B\n0.384944 0.115056 0.000000 B\n0.821980 0.678020 0.500000 W\n0.178020 0.321980 0.500000 W\n0.678020 0.178020 0.500000 W\n0.321980 0.821980 0.500000 W\n",
"nsites": 10,
"nelements": 3,
"elements": [
"Mn",
"B",
"W"
],
"chemical_system": "B-Mn-W",
"density": 13.92307981287222,
"density_atomic": 0.09437099088490168,
"volume": 105.96476635702984,
"volume_molar": 6.38134738602546,
"formula_full": "Mn2 B4 W4",
"formula_reduced": "Mn(BW)2",
"formula_anonymous": "AB2C2",
"energy_above_hull": 6.151102481609195,
"spacegroup": 127
},
{
"id": "jvasp-36872",
"created_at": "2022-09-04T14:38:03.982255Z",
"updated_at": "2022-09-04T14:38:03.982285Z",
"structure_string": "B1 Os1\n1.0\n1.455521 -2.521036 -0.000000\n1.455521 2.521036 -0.000000\n0.000000 -0.000000 2.887715\nB Os\n1 1\ndirect\n0.666667 0.333332 0.499999 B\n0.000000 0.000000 0.000000 Os\n",
"nsites": 2,
"nelements": 2,
"elements": [
"B",
"Os"
],
"chemical_system": "B-Os",
"density": 15.752586958739936,
"density_atomic": 0.09437308412956091,
"volume": 21.192483200551997,
"volume_molar": 6.381205844382972,
"formula_full": "B1 Os1",
"formula_reduced": "BOs",
"formula_anonymous": "AB",
"energy_above_hull": 3.3723037916666674,
"spacegroup": 187
},
{
"id": "jvasp-116814",
"created_at": "2022-09-04T14:38:43.440018Z",
"updated_at": "2022-09-04T14:38:43.440047Z",
"structure_string": "V6 O8 F4\n1.0\n4.615767 0.007535 0.102044\n0.120000 5.477932 0.443668\n0.000033 0.136787 7.554596\nV O F\n6 8 4\ndirect\n0.509171 0.833333 0.658211 V\n0.476089 0.510883 0.991702 V\n0.509998 0.178189 0.361579 V\n0.001456 0.344748 0.672502 V\n0.968639 0.643905 0.311208 V\n0.025596 0.992949 0.999842 V\n0.192427 0.296593 0.904175 O\n0.297664 0.799697 0.892999 O\n0.303104 0.455843 0.234915 O\n0.299266 0.139343 0.573895 O\n0.698773 0.537239 0.765307 O\n0.794809 0.697218 0.095589 O\n0.801609 0.370044 0.436027 O\n0.709317 0.866876 0.429662 O\n0.212369 0.961619 0.236469 F\n0.797121 0.037045 0.771187 F\n0.699036 0.194703 0.106446 F\n0.203554 0.639771 0.558288 F\n",
"nsites": 18,
"nelements": 3,
"elements": [
"V",
"O",
"F"
],
"chemical_system": "F-O-V",
"density": 4.436986558198413,
"density_atomic": 0.09437345992643904,
"volume": 190.7315893051966,
"volume_molar": 6.381180434302247,
"formula_full": "V6 O8 F4",
"formula_reduced": "V3(O2F)2",
"formula_anonymous": "A2B3C4",
"energy_above_hull": 2.650704129444444,
"spacegroup": 1
},
{
"id": "jvasp-51638",
"created_at": "2022-09-04T14:38:36.619813Z",
"updated_at": "2022-09-04T14:38:36.619835Z",
"structure_string": "Ge12 N16\n1.0\n4.914313 -0.000000 0.000000\n0.000000 5.977230 0.000000\n0.000000 0.000000 10.100432\nGe N\n12 16\ndirect\n0.552538 0.750000 0.095964 Ge\n0.500000 0.500000 0.500000 Ge\n0.000000 0.500000 0.000000 Ge\n0.015965 0.750000 0.279521 Ge\n0.000000 0.000000 0.000000 Ge\n0.447462 0.250000 0.904036 Ge\n0.984034 0.250000 0.720478 Ge\n0.500000 0.000000 0.500000 Ge\n0.515965 0.250000 0.220478 Ge\n0.052538 0.250000 0.404036 Ge\n0.947461 0.750000 0.595964 Ge\n0.484034 0.750000 0.779521 Ge\n0.255565 0.004115 0.837627 N\n0.319375 0.750000 0.594562 N\n0.255565 0.495885 0.837627 N\n0.180625 0.750000 0.094562 N\n0.819375 0.250000 0.905437 N\n0.757714 0.750000 0.430752 N\n0.744435 0.995885 0.162373 N\n0.755564 0.504116 0.662373 N\n0.755564 0.995885 0.662373 N\n0.742285 0.750000 0.930752 N\n0.257715 0.250000 0.069248 N\n0.744435 0.504116 0.162373 N\n0.244435 0.004115 0.337627 N\n0.680625 0.250000 0.405437 N\n0.242285 0.250000 0.569248 N\n0.244435 0.495885 0.337627 N\n",
"nsites": 28,
"nelements": 2,
"elements": [
"Ge",
"N"
],
"chemical_system": "Ge-N",
"density": 6.13299470849582,
"density_atomic": 0.09437463843112005,
"volume": 296.68987839816714,
"volume_molar": 6.381100749218021,
"formula_full": "Ge12 N16",
"formula_reduced": "Ge3N4",
"formula_anonymous": "A3B4",
"energy_above_hull": 3.7647758357142855,
"spacegroup": 62
},
{
"id": "jvasp-46281",
"created_at": "2022-09-04T14:38:04.969203Z",
"updated_at": "2022-09-04T14:38:04.969220Z",
"structure_string": "Li4 Al2 Co2 O8\n1.0\n0.000000 4.975939 0.012863\n5.403730 0.000000 0.000000\n0.000000 -4.945267 -6.317939\nLi Al Co O\n4 2 2 8\ndirect\n0.255065 0.331849 0.752707 Li\n0.506291 0.832369 0.004156 Li\n0.255066 0.668151 0.252707 Li\n0.506291 0.167631 0.504156 Li\n0.750964 0.669538 0.753668 Al\n0.750964 0.330462 0.253668 Al\n0.999384 0.166634 -0.000095 Co\n0.999384 0.833366 0.499905 Co\n0.381398 0.678908 0.743378 O\n0.641530 0.181101 0.020790 O\n0.087688 0.166784 0.485580 O\n0.866283 0.645119 0.262720 O\n0.381399 0.321092 0.243378 O\n0.641530 0.818899 0.520790 O\n0.087687 0.833216 0.985580 O\n0.866283 0.354881 0.762720 O\n",
"nsites": 16,
"nelements": 4,
"elements": [
"Li",
"Al",
"Co",
"O"
],
"chemical_system": "Al-Co-Li-O",
"density": 3.208584568978774,
"density_atomic": 0.09437468316147693,
"volume": 169.53699301563415,
"volume_molar": 6.381097724795537,
"formula_full": "Li4 Al2 Co2 O8",
"formula_reduced": "Li2AlCoO4",
"formula_anonymous": "ABC2D4",
"energy_above_hull": 2.0587109625,
"spacegroup": 7
},
{
"id": "jvasp-56942",
"created_at": "2022-09-04T14:37:29.942336Z",
"updated_at": "2022-09-04T14:37:29.942365Z",
"structure_string": "Mo4 C4\n1.0\n1.513277 -2.621074 -0.000000\n1.513277 2.621074 0.000000\n0.000000 -0.000000 10.685509\nMo C\n4 4\ndirect\n0.333334 0.666668 0.619911 Mo\n0.666668 0.333334 0.380089 Mo\n0.666668 0.333334 0.119911 Mo\n0.333334 0.666668 0.880089 Mo\n0.333334 0.666668 0.250000 C\n0.000000 0.000000 0.000000 C\n0.000000 0.000000 0.500000 C\n0.666668 0.333334 0.750000 C\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Mo",
"C"
],
"chemical_system": "C-Mo",
"density": 8.458855921233392,
"density_atomic": 0.09437719448568815,
"volume": 84.76624086566974,
"volume_molar": 6.380927927364093,
"formula_full": "Mo4 C4",
"formula_reduced": "MoC",
"formula_anonymous": "AB",
"energy_above_hull": 4.019187949999999,
"spacegroup": 194
},
{
"id": "jvasp-50719",
"created_at": "2022-09-04T14:36:20.688809Z",
"updated_at": "2022-09-04T14:36:20.688832Z",
"structure_string": "Li8 Cu4 F16\n1.0\n7.450196 0.000000 -0.000000\n-0.000000 7.450196 0.000000\n-0.000000 -0.000000 5.344650\nLi Cu F\n8 4 16\ndirect\n0.171387 0.171387 0.250000 Li\n0.828613 0.171387 0.750000 Li\n0.328613 0.328613 0.750000 Li\n0.671388 0.328613 0.250000 Li\n0.328613 0.671388 0.250000 Li\n0.671388 0.671388 0.750000 Li\n0.171387 0.828613 0.750000 Li\n0.828613 0.828613 0.250000 Li\n0.000000 0.500000 0.944085 Cu\n0.000000 0.500000 0.444085 Cu\n0.500000 0.000000 0.555915 Cu\n0.500000 0.000000 0.055915 Cu\n0.568598 0.756190 0.070168 F\n0.431403 0.756190 0.570168 F\n0.068598 0.743810 0.429832 F\n0.931403 0.743810 0.929832 F\n0.756190 0.568598 0.429832 F\n0.243810 0.568598 0.929832 F\n0.756190 0.431403 0.929832 F\n0.743810 0.068598 0.070168 F\n0.931403 0.256190 0.429832 F\n0.068598 0.256190 0.929832 F\n0.568598 0.243810 0.570168 F\n0.431403 0.243810 0.070168 F\n0.256190 0.931403 0.070168 F\n0.256190 0.068598 0.570168 F\n0.243810 0.431403 0.429832 F\n0.743810 0.931403 0.570168 F\n",
"nsites": 28,
"nelements": 3,
"elements": [
"Li",
"Cu",
"F"
],
"chemical_system": "Cu-F-Li",
"density": 3.4351125073451283,
"density_atomic": 0.0943850835139471,
"volume": 296.6570453461801,
"volume_molar": 6.380394587572856,
"formula_full": "Li8 Cu4 F16",
"formula_reduced": "Li2CuF4",
"formula_anonymous": "AB2C4",
"energy_above_hull": 0.0593514689285713,
"spacegroup": 130
},
{
"id": "jvasp-51767",
"created_at": "2022-09-04T14:36:40.338208Z",
"updated_at": "2022-09-04T14:36:40.338232Z",
"structure_string": "Mn2 H4 S2 O10\n1.0\n3.069704 3.946828 -1.607439\n-3.069704 3.946828 1.607439\n0.115112 0.000000 7.809456\nMn H S O\n2 4 2 10\ndirect\n0.500000 0.500000 0.500000 Mn\n0.500000 0.500000 0.000000 Mn\n0.414052 0.149789 0.790717 H\n0.149789 0.414052 0.709283 H\n0.585948 0.850211 0.209283 H\n0.850211 0.585948 0.290717 H\n0.841488 0.841489 0.750000 S\n0.158512 0.158512 0.250000 S\n0.377316 0.162601 0.163127 O\n0.162601 0.377316 0.336873 O\n0.622684 0.837399 0.836873 O\n0.837399 0.622685 0.663127 O\n0.113176 0.782077 0.899446 O\n0.886824 0.217924 0.100554 O\n0.782076 0.113177 0.600554 O\n0.354442 0.354442 0.750000 O\n0.217924 0.886824 0.399446 O\n0.645558 0.645558 0.250000 O\n",
"nsites": 18,
"nelements": 4,
"elements": [
"Mn",
"H",
"S",
"O"
],
"chemical_system": "H-Mn-O-S",
"density": 2.943553759077863,
"density_atomic": 0.09439255839429289,
"volume": 190.69299853926097,
"volume_molar": 6.3798893286105764,
"formula_full": "Mn2 H4 S2 O10",
"formula_reduced": "MnH2SO5",
"formula_anonymous": "ABC2D5",
"energy_above_hull": 2.918173860153256,
"spacegroup": 15
},
{
"id": "jvasp-110290",
"created_at": "2022-09-04T14:38:15.670091Z",
"updated_at": "2022-09-04T14:38:15.670107Z",
"structure_string": "Al1 W3 C4\n1.0\n2.832134 -0.000000 0.000000\n0.000000 2.946955 0.000000\n-0.000000 -0.000000 10.154505\nAl W C\n1 3 4\ndirect\n0.000000 0.000000 0.739202 Al\n-0.000000 0.499999 0.002166 W\n0.000000 0.000000 0.251448 W\n-0.000000 0.499999 0.501622 W\n0.499999 0.499999 0.168020 C\n0.499999 0.000000 0.417676 C\n0.499999 0.499999 0.661608 C\n0.499999 0.000000 0.924957 C\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Al",
"W",
"C"
],
"chemical_system": "Al-C-W",
"density": 12.275942563147101,
"density_atomic": 0.09439389942321925,
"volume": 84.75123973988661,
"volume_molar": 6.379798691226287,
"formula_full": "Al1 W3 C4",
"formula_reduced": "AlW3C4",
"formula_anonymous": "AB3C4",
"energy_above_hull": 7.243185349999999,
"spacegroup": 25
},
{
"id": "jvasp-79304",
"created_at": "2022-09-04T14:36:42.370615Z",
"updated_at": "2022-09-04T14:36:42.370642Z",
"structure_string": "N4\n1.0\n3.284968 0.000000 0.000000\n0.000000 2.181027 0.000000\n0.000000 0.000000 5.914321\nN\n4\ndirect\n0.857089 0.507560 0.250000 N\n0.642912 0.007559 0.250000 N\n0.142912 0.492441 0.750000 N\n0.357088 0.992442 0.750000 N\n",
"nsites": 4,
"nelements": 1,
"elements": [
"N"
],
"chemical_system": "N",
"density": 2.195572781735291,
"density_atomic": 0.09439802626602938,
"volume": 42.37376731508488,
"volume_molar": 6.37951978257321,
"formula_full": "N4",
"formula_reduced": "N",
"formula_anonymous": "A",
"energy_above_hull": 1.0562432499999996,
"spacegroup": 74
}
]
}