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=energy_above_hull&page=4537",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=energy_above_hull&page=4535",
"results": [
{
"id": "jvasp-103784",
"created_at": "2022-09-04T14:37:03.113759Z",
"updated_at": "2022-09-04T14:37:03.113792Z",
"structure_string": "H8 C8 O1\n1.0\n3.892773 0.018714 -0.270524\n-1.829326 5.100359 -2.213079\n0.001850 -0.095382 7.197318\nH C O\n8 8 1\ndirect\n0.259994 0.165315 0.216383 H\n0.357020 0.769983 0.963491 H\n0.616898 0.212061 0.811512 H\n0.878956 0.606500 0.872767 H\n0.831008 0.025565 0.891011 H\n0.729615 0.636048 0.587081 H\n0.839662 0.415094 0.237613 H\n0.150961 0.385832 0.565231 H\n0.140565 0.047405 0.296575 C\n0.931324 0.026684 0.601530 C\n0.053245 0.773328 0.201770 C\n0.114226 0.640111 0.986299 C\n0.903728 0.627639 0.308217 C\n0.866349 0.160328 0.815903 C\n0.078684 0.172230 0.493666 C\n0.844846 0.753342 0.505914 C\n0.170824 0.394297 0.944476 O\n",
"nsites": 17,
"nelements": 3,
"elements": [
"H",
"C",
"O"
],
"chemical_system": "C-H-O",
"density": 1.4022502957575433,
"density_atomic": 0.11948322567791166,
"volume": 142.2793861108716,
"volume_molar": 5.040155825917987,
"formula_full": "H8 C8 O1",
"formula_reduced": "H8C8O",
"formula_anonymous": "AB8C8",
"energy_above_hull": 5.244747852941176,
"spacegroup": 1
},
{
"id": "jvasp-101188",
"created_at": "2022-09-04T14:36:44.412529Z",
"updated_at": "2022-09-04T14:36:44.412552Z",
"structure_string": "Hf1 Ta1 N2\n1.0\n3.039356 0.005675 4.550747\n1.384146 2.705893 4.550747\n0.009257 0.005675 5.472376\nHf Ta N\n1 1 2\ndirect\n0.000000 0.000000 0.000000 Hf\n0.500003 0.499998 0.500000 Ta\n0.250198 0.250195 0.250197 N\n0.749808 0.749800 0.749804 N\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Hf",
"Ta",
"N"
],
"chemical_system": "Hf-N-Ta",
"density": 14.35910300989534,
"density_atomic": 0.08927320053536793,
"volume": 44.80627977951003,
"volume_molar": 6.745743094103779,
"formula_full": "Hf1 Ta1 N2",
"formula_reduced": "HfTaN2",
"formula_anonymous": "ABC2",
"energy_above_hull": 5.245402175,
"spacegroup": 166
},
{
"id": "jvasp-108055",
"created_at": "2022-09-04T14:38:20.437924Z",
"updated_at": "2022-09-04T14:38:20.437933Z",
"structure_string": "V1 Cr1 C2\n1.0\n2.792990 -0.002394 4.171689\n1.265792 2.489693 4.171689\n-0.003906 -0.002394 5.020335\nV Cr C\n1 1 2\ndirect\n0.000000 0.000000 0.000000 V\n0.499999 0.500001 0.500001 Cr\n0.248609 0.248610 0.248610 C\n0.751388 0.751392 0.751392 C\n",
"nsites": 4,
"nelements": 3,
"elements": [
"V",
"Cr",
"C"
],
"chemical_system": "C-Cr-V",
"density": 6.026725798173279,
"density_atomic": 0.11434806856092188,
"volume": 34.980914416310384,
"volume_molar": 5.26649976321336,
"formula_full": "V1 Cr1 C2",
"formula_reduced": "VCrC2",
"formula_anonymous": "ABC2",
"energy_above_hull": 5.2465904000000005,
"spacegroup": 166
},
{
"id": "jvasp-99501",
"created_at": "2022-09-04T14:36:34.223179Z",
"updated_at": "2022-09-04T14:36:34.223200Z",
"structure_string": "Th1 U1 C2\n1.0\n3.484469 0.004727 5.229719\n1.586177 3.102513 5.229719\n0.007714 0.004727 6.284220\nTh U C\n1 1 2\ndirect\n0.500000 0.500000 0.500000 Th\n0.000000 0.000000 0.000000 U\n0.265646 0.265647 0.265646 C\n0.734353 0.734354 0.734353 C\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Th",
"U",
"C"
],
"chemical_system": "C-Th-U",
"density": 12.11586701568417,
"density_atomic": 0.05906915527933258,
"volume": 67.71723721262593,
"volume_molar": 10.195068359318586,
"formula_full": "Th1 U1 C2",
"formula_reduced": "ThUC2",
"formula_anonymous": "ABC2",
"energy_above_hull": 5.2482804,
"spacegroup": 166
},
{
"id": "jvasp-37188",
"created_at": "2022-09-04T14:38:09.917706Z",
"updated_at": "2022-09-04T14:38:09.917737Z",
"structure_string": "W1 N2\n1.0\n1.464682 -2.536903 -0.000000\n1.464682 2.536903 0.000000\n-0.000000 -0.000000 3.922011\nW N\n1 2\ndirect\n0.666666 0.333333 0.500000 W\n0.000000 0.000000 0.819107 N\n0.000000 0.000000 0.180893 N\n",
"nsites": 3,
"nelements": 2,
"elements": [
"W",
"N"
],
"chemical_system": "N-W",
"density": 12.06975699303064,
"density_atomic": 0.10292840555234449,
"volume": 29.146473064467543,
"volume_molar": 5.8508054483924035,
"formula_full": "W1 N2",
"formula_reduced": "WN2",
"formula_anonymous": "AB2",
"energy_above_hull": 5.2487821666666665,
"spacegroup": 187
},
{
"id": "jvasp-90755",
"created_at": "2022-09-04T14:35:51.265891Z",
"updated_at": "2022-09-04T14:35:51.265911Z",
"structure_string": "Sc3 Ir1 C4\n1.0\n3.442839 0.000000 0.000000\n0.000000 4.451653 0.000000\n-1.721420 -2.225826 6.125119\nSc Ir C\n3 1 4\ndirect\n0.500000 0.500000 -0.000000 Sc\n0.309815 0.809814 0.619632 Sc\n0.690185 0.190184 0.380368 Sc\n0.000000 0.000000 0.000000 Ir\n0.871767 0.209659 0.743533 C\n0.128233 0.790340 0.256467 C\n0.128233 0.466126 0.256467 C\n0.871767 0.533872 0.743533 C\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Sc",
"Ir",
"C"
],
"chemical_system": "C-Ir-Sc",
"density": 6.635528104151295,
"density_atomic": 0.08521919707636581,
"volume": 93.87556178018336,
"volume_molar": 7.066648087054255,
"formula_full": "Sc3 Ir1 C4",
"formula_reduced": "Sc3IrC4",
"formula_anonymous": "AB3C4",
"energy_above_hull": 5.24885835625,
"spacegroup": 71
},
{
"id": "jvasp-14974",
"created_at": "2022-09-04T14:35:58.908381Z",
"updated_at": "2022-09-04T14:35:58.908405Z",
"structure_string": "Ta5 Sb4\n1.0\n3.491584 -0.000000 0.854476\n1.745792 7.323859 0.427238\n0.004839 -0.000000 7.541168\nTa Sb\n5 4\ndirect\n0.625371 0.060217 0.689041 Ta\n0.314411 0.310960 0.060217 Ta\n0.685588 0.689040 0.939784 Ta\n0.374628 0.939783 0.310961 Ta\n0.000000 0.000000 0.000000 Ta\n0.704060 0.241722 0.350157 Sb\n0.054217 0.649844 0.241722 Sb\n0.945782 0.350156 0.758279 Sb\n0.295938 0.758278 0.649844 Sb\n",
"nsites": 9,
"nelements": 2,
"elements": [
"Ta",
"Sb"
],
"chemical_system": "Sb-Ta",
"density": 11.986340778290662,
"density_atomic": 0.04667771936430834,
"volume": 192.81147670813073,
"volume_molar": 12.90153169866472,
"formula_full": "Ta5 Sb4",
"formula_reduced": "Ta5Sb4",
"formula_anonymous": "A4B5",
"energy_above_hull": 5.248972266666666,
"spacegroup": 87
},
{
"id": "jvasp-110989",
"created_at": "2022-09-04T14:38:36.397996Z",
"updated_at": "2022-09-04T14:38:36.398028Z",
"structure_string": "Ta1 V1 B4\n1.0\n3.052534 0.000000 0.000000\n-1.526267 2.643572 0.000000\n-0.000000 -0.000000 6.395662\nTa V B\n1 1 4\ndirect\n0.000000 0.000000 0.000000 Ta\n0.000000 0.000000 0.500000 V\n0.666665 0.333333 0.736893 B\n0.666665 0.333333 0.263107 B\n0.333332 0.666666 0.736893 B\n0.333332 0.666666 0.263107 B\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Ta",
"V",
"B"
],
"chemical_system": "B-Ta-V",
"density": 8.852281660115445,
"density_atomic": 0.11625565656076564,
"volume": 51.61039193704834,
"volume_molar": 5.180084082061236,
"formula_full": "Ta1 V1 B4",
"formula_reduced": "TaVB4",
"formula_anonymous": "ABC4",
"energy_above_hull": 5.249078955555557,
"spacegroup": 191
},
{
"id": "jvasp-100722",
"created_at": "2022-09-04T14:36:43.145432Z",
"updated_at": "2022-09-04T14:36:43.145452Z",
"structure_string": "Hf1 Zr1 Os2\n1.0\n4.006686 -0.000000 2.313262\n1.335562 3.777540 2.313262\n0.000000 -0.000000 4.626523\nHf Zr Os\n1 1 2\ndirect\n0.500000 0.500000 0.499999 Hf\n0.000000 0.000000 0.000000 Zr\n0.250000 0.250000 0.250000 Os\n0.750000 0.750000 0.749999 Os\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Hf",
"Zr",
"Os"
],
"chemical_system": "Hf-Os-Zr",
"density": 15.418054980819278,
"density_atomic": 0.05712298392245748,
"volume": 70.02435316456621,
"volume_molar": 10.542412784624227,
"formula_full": "Hf1 Zr1 Os2",
"formula_reduced": "HfZrOs2",
"formula_anonymous": "ABC2",
"energy_above_hull": 5.249279375,
"spacegroup": 225
},
{
"id": "jvasp-110162",
"created_at": "2022-09-04T14:38:20.582028Z",
"updated_at": "2022-09-04T14:38:20.582055Z",
"structure_string": "Ta1 B2 Mo1\n1.0\n4.597764 0.005931 0.000000\n-3.454583 3.034028 0.000000\n0.000000 0.000000 3.123671\nTa B Mo\n1 2 1\ndirect\n0.853447 0.146552 -0.000000 Ta\n0.441546 0.558454 0.500000 B\n0.559874 0.440126 -0.000000 B\n0.145132 0.854870 0.500000 Mo\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ta",
"B",
"Mo"
],
"chemical_system": "B-Mo-Ta",
"density": 11.358967212014623,
"density_atomic": 0.09166235899812257,
"volume": 43.6384143253604,
"volume_molar": 6.56991684026302,
"formula_full": "Ta1 B2 Mo1",
"formula_reduced": "TaB2Mo",
"formula_anonymous": "ABC2",
"energy_above_hull": 5.250585066666666,
"spacegroup": 38
},
{
"id": "jvasp-79716",
"created_at": "2022-09-04T14:37:05.856898Z",
"updated_at": "2022-09-04T14:37:05.856908Z",
"structure_string": "Ta2 Os1 Pd1\n1.0\n-10.613104 1.854309 -3.099588\n-7.409039 1.100013 0.428988\n-6.568901 3.476224 -1.026108\nTa Os Pd\n2 1 1\ndirect\n0.748357 0.000114 0.000116 Ta\n0.251650 -0.000122 -0.000122 Ta\n0.499997 0.000002 0.000003 Os\n-0.000005 0.000004 0.000004 Pd\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ta",
"Os",
"Pd"
],
"chemical_system": "Os-Pd-Ta",
"density": 16.589508017231044,
"density_atomic": 0.06068179830263499,
"volume": 65.91762459067249,
"volume_molar": 9.92413034624668,
"formula_full": "Ta2 Os1 Pd1",
"formula_reduced": "Ta2OsPd",
"formula_anonymous": "ABC2",
"energy_above_hull": 5.251839775,
"spacegroup": 12
},
{
"id": "jvasp-20072",
"created_at": "2022-09-04T14:35:48.555123Z",
"updated_at": "2022-09-04T14:35:48.555151Z",
"structure_string": "U2 Os4\n1.0\n4.632132 -0.000000 2.674362\n1.544044 4.367216 2.674362\n0.000000 0.000000 5.348725\nU Os\n2 4\ndirect\n0.874999 0.875001 0.874999 U\n0.125000 0.125000 0.125000 U\n0.499999 0.500000 0.499999 Os\n0.499999 0.500000 -0.000000 Os\n-0.000001 0.500000 0.499999 Os\n0.500000 0.000000 0.499999 Os\n",
"nsites": 6,
"nelements": 2,
"elements": [
"U",
"Os"
],
"chemical_system": "Os-U",
"density": 18.983449927834144,
"density_atomic": 0.05545176595745392,
"volume": 108.20214462788394,
"volume_molar": 10.860142424716582,
"formula_full": "U2 Os4",
"formula_reduced": "UOs2",
"formula_anonymous": "AB2",
"energy_above_hull": 5.252908666666667,
"spacegroup": 227
}
]
}