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=nelements&page=591",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=nelements&page=589",
"results": [
{
"id": "jvasp-110475",
"created_at": "2022-09-04T14:38:39.561052Z",
"updated_at": "2022-09-04T14:38:39.561075Z",
"structure_string": "Tc6 W2\n1.0\n5.569057 -0.000000 0.000000\n-2.784530 4.822945 0.000000\n0.000000 0.000000 4.453992\nTc W\n6 2\ndirect\n0.166875 0.333751 0.250000 Tc\n0.666250 0.833126 0.250000 Tc\n0.166875 0.833126 0.250000 Tc\n0.833126 0.666250 0.750000 Tc\n0.333751 0.166875 0.750000 Tc\n0.833126 0.166875 0.750000 Tc\n0.333333 0.666668 0.750000 W\n0.666667 0.333333 0.250000 W\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Tc",
"W"
],
"chemical_system": "Tc-W",
"density": 13.26533401889268,
"density_atomic": 0.06687234950426503,
"volume": 119.63090962565582,
"volume_molar": 9.005427212656729,
"formula_full": "Tc6 W2",
"formula_reduced": "Tc3W",
"formula_anonymous": "AB3",
"energy_above_hull": 6.118653624999999,
"spacegroup": 194
},
{
"id": "jvasp-16801",
"created_at": "2022-09-04T14:38:31.799735Z",
"updated_at": "2022-09-04T14:38:31.799749Z",
"structure_string": "Cd3 In1\n1.0\n4.580242 0.000000 0.000000\n0.000000 4.580242 0.000000\n0.000000 -0.000000 4.580242\nCd In\n3 1\ndirect\n0.500000 0.500000 0.000000 Cd\n0.500000 0.000000 0.500000 Cd\n0.000000 0.500000 0.500000 Cd\n0.000000 0.000000 0.000000 In\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Cd",
"In"
],
"chemical_system": "Cd-In",
"density": 7.812162299146595,
"density_atomic": 0.041628879061596236,
"volume": 96.08714167108353,
"volume_molar": 14.466257309233166,
"formula_full": "Cd3 In1",
"formula_reduced": "Cd3In",
"formula_anonymous": "AB3",
"energy_above_hull": 0.0,
"spacegroup": 221
},
{
"id": "jvasp-37780",
"created_at": "2022-09-04T14:38:34.129414Z",
"updated_at": "2022-09-04T14:38:34.129445Z",
"structure_string": "Ga3 Bi1\n1.0\n4.567680 0.000000 0.000000\n0.000000 4.567680 -0.000000\n0.000000 -0.000000 4.567680\nGa Bi\n3 1\ndirect\n0.000000 0.500000 0.500000 Ga\n0.500000 0.000000 0.500000 Ga\n0.500000 0.500000 0.000000 Ga\n0.000000 0.000000 0.000000 Bi\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Ga",
"Bi"
],
"chemical_system": "Bi-Ga",
"density": 7.286073755346644,
"density_atomic": 0.04197328682772474,
"volume": 95.29870787621684,
"volume_molar": 14.34755582691746,
"formula_full": "Ga3 Bi1",
"formula_reduced": "Ga3Bi",
"formula_anonymous": "AB3",
"energy_above_hull": 0.0,
"spacegroup": 221
},
{
"id": "jvasp-33877",
"created_at": "2022-09-04T14:38:39.726101Z",
"updated_at": "2022-09-04T14:38:39.726126Z",
"structure_string": "As6 W2\n1.0\n6.144603 -0.000000 -0.000000\n-3.072301 5.321381 0.000000\n-0.000000 -0.000000 4.581277\nAs W\n6 2\ndirect\n0.188043 0.376086 0.249999 As\n0.623914 0.811955 0.249999 As\n0.188043 0.811955 0.249999 As\n0.811957 0.623914 0.750001 As\n0.376085 0.188044 0.750001 As\n0.811957 0.188044 0.750001 As\n0.333334 0.666668 0.750001 W\n0.666666 0.333332 0.249999 W\n",
"nsites": 8,
"nelements": 2,
"elements": [
"As",
"W"
],
"chemical_system": "As-W",
"density": 9.058949163464405,
"density_atomic": 0.05340540984239019,
"volume": 149.7975584048426,
"volume_molar": 11.27627477772854,
"formula_full": "As6 W2",
"formula_reduced": "As3W",
"formula_anonymous": "AB3",
"energy_above_hull": 3.8696763125,
"spacegroup": 194
},
{
"id": "jvasp-55030",
"created_at": "2022-09-04T14:38:31.803944Z",
"updated_at": "2022-09-04T14:38:31.803970Z",
"structure_string": "Dy12 Al8\n1.0\n8.211412 0.000000 0.000000\n-0.000000 8.211412 0.000000\n0.000000 0.000000 7.549840\nDy Al\n12 8\ndirect\n0.500000 0.000000 0.506190 Dy\n0.350479 0.649520 0.756197 Dy\n0.796992 0.796992 0.756209 Dy\n0.000000 0.500000 0.006190 Dy\n0.703008 0.296992 0.256209 Dy\n0.149521 0.149521 0.256196 Dy\n0.850479 0.850479 0.256196 Dy\n0.203008 0.203008 0.756209 Dy\n0.296992 0.703008 0.256209 Dy\n0.000000 0.500000 0.506190 Dy\n0.649520 0.350479 0.756197 Dy\n0.500000 0.000000 0.006190 Dy\n0.880665 0.119335 0.562153 Al\n0.619335 0.619335 0.062153 Al\n0.619341 0.619341 0.450250 Al\n0.119335 0.880665 0.562153 Al\n0.119341 0.880659 0.950250 Al\n0.380665 0.380665 0.062153 Al\n0.880659 0.119341 0.950250 Al\n0.380659 0.380659 0.450250 Al\n",
"nsites": 20,
"nelements": 2,
"elements": [
"Dy",
"Al"
],
"chemical_system": "Al-Dy",
"density": 7.0648753209056,
"density_atomic": 0.03928769609652579,
"volume": 509.0652287388417,
"volume_molar": 15.328312317434511,
"formula_full": "Dy12 Al8",
"formula_reduced": "Dy3Al2",
"formula_anonymous": "A2B3",
"energy_above_hull": 1.55144502,
"spacegroup": 136
},
{
"id": "jvasp-116336",
"created_at": "2022-09-04T14:38:40.886507Z",
"updated_at": "2022-09-04T14:38:40.886535Z",
"structure_string": "Mn1 F1\n1.0\n2.724284 -0.184106 -0.487046\n-1.524737 -2.286519 -0.056971\n1.088181 -1.473246 -4.220012\nMn F\n1 1\ndirect\n0.145274 0.820509 0.064209 Mn\n0.645420 0.320644 0.564193 F\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Mn",
"F"
],
"chemical_system": "F-Mn",
"density": 4.921119177946927,
"density_atomic": 0.08016525845658175,
"volume": 24.948463193481984,
"volume_molar": 7.512157854841381,
"formula_full": "Mn1 F1",
"formula_reduced": "MnF",
"formula_anonymous": "AB",
"energy_above_hull": 0.7671787619396551,
"spacegroup": 12
},
{
"id": "jvasp-103262",
"created_at": "2022-09-04T14:38:39.795616Z",
"updated_at": "2022-09-04T14:38:39.795633Z",
"structure_string": "K1 Hg3\n1.0\n4.512017 -0.206912 -3.635374\n-1.160764 4.365058 -3.635374\n0.166760 0.206912 5.791928\nK Hg\n1 3\ndirect\n0.000000 0.000000 0.000000 K\n0.750001 0.250000 0.500001 Hg\n0.250001 0.750000 0.500002 Hg\n0.500001 0.500000 0.000002 Hg\n",
"nsites": 4,
"nelements": 2,
"elements": [
"K",
"Hg"
],
"chemical_system": "Hg-K",
"density": 8.888893489698868,
"density_atomic": 0.033411025519042264,
"volume": 119.72095851174164,
"volume_molar": 18.02441160199571,
"formula_full": "K1 Hg3",
"formula_reduced": "KHg3",
"formula_anonymous": "AB3",
"energy_above_hull": 0.252576447368421,
"spacegroup": 139
},
{
"id": "jvasp-31824",
"created_at": "2022-09-04T14:38:39.562760Z",
"updated_at": "2022-09-04T14:38:39.562774Z",
"structure_string": "Au8 F40\n1.0\n4.802626 0.000000 0.000000\n0.000000 9.229793 0.000000\n0.000000 0.000000 14.953358\nAu F\n8 40\ndirect\n0.073356 0.130754 0.356651 Au\n0.073356 0.130754 0.143349 Au\n0.573356 0.369245 0.856651 Au\n0.426645 0.630754 0.356651 Au\n0.573356 0.369245 0.643350 Au\n0.926645 0.869245 0.856651 Au\n0.426645 0.630754 0.143349 Au\n0.926645 0.869245 0.643350 Au\n0.260525 0.500843 0.644766 F\n0.739476 0.499157 0.144766 F\n0.239475 0.000843 0.855235 F\n0.239475 0.000843 0.644766 F\n0.739476 0.499157 0.355235 F\n0.260525 0.500843 0.855235 F\n0.760525 0.999157 0.144766 F\n0.905235 0.243930 0.447700 F\n0.594766 0.743930 0.052301 F\n0.760525 0.999157 0.355235 F\n0.094765 0.756070 0.552301 F\n0.594766 0.743930 0.447700 F\n0.405235 0.256070 0.947700 F\n0.905235 0.243930 0.052301 F\n0.405235 0.256070 0.552301 F\n0.094765 0.756070 0.947700 F\n0.252161 0.024010 0.051271 F\n0.742360 0.480043 0.750000 F\n0.752162 0.475990 0.948729 F\n0.247839 0.524010 0.448729 F\n0.747840 0.975990 0.551271 F\n0.747840 0.975990 0.948729 F\n0.247839 0.524010 0.051271 F\n0.752162 0.475990 0.551271 F\n0.252161 0.024010 0.448729 F\n0.383791 0.263551 0.351676 F\n0.883791 0.236448 0.648324 F\n0.257640 0.519956 0.250000 F\n0.116209 0.763551 0.148324 F\n0.616210 0.736448 0.648324 F\n0.116209 0.763551 0.351676 F\n0.883791 0.236448 0.851676 F\n0.383791 0.263551 0.148324 F\n0.897920 0.238575 0.250000 F\n0.397920 0.261425 0.750000 F\n0.602081 0.738575 0.250000 F\n0.102081 0.761425 0.750000 F\n0.242360 0.019956 0.250000 F\n0.616210 0.736448 0.851676 F\n0.757641 0.980043 0.750000 F\n",
"nsites": 48,
"nelements": 2,
"elements": [
"Au",
"F"
],
"chemical_system": "Au-F",
"density": 5.851279920957295,
"density_atomic": 0.07241554069528816,
"volume": 662.8411462392519,
"volume_molar": 8.316088925359416,
"formula_full": "Au8 F40",
"formula_reduced": "AuF5",
"formula_anonymous": "AB5",
"energy_above_hull": 0.0,
"spacegroup": 62
},
{
"id": "jvasp-113735",
"created_at": "2022-09-04T14:38:47.008598Z",
"updated_at": "2022-09-04T14:38:47.008630Z",
"structure_string": "Si2 Os2\n1.0\n5.993043 -0.781400 0.336260\n-1.624256 -2.306740 -0.052300\n0.116734 3.499123 -5.583038\nSi Os\n2 2\ndirect\n0.748675 0.436066 0.154973 Si\n0.698452 0.367120 0.637375 Si\n0.017262 0.081939 0.032865 Os\n0.424970 0.270385 0.313786 Os\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Si",
"Os"
],
"chemical_system": "Os-Si",
"density": 8.678054492052325,
"density_atomic": 0.04787609280344227,
"volume": 83.5490067333231,
"volume_molar": 12.578596972656486,
"formula_full": "Si2 Os2",
"formula_reduced": "SiOs",
"formula_anonymous": "AB",
"energy_above_hull": 3.1733818000000005,
"spacegroup": 6
},
{
"id": "jvasp-20296",
"created_at": "2022-09-04T14:38:34.138088Z",
"updated_at": "2022-09-04T14:38:34.138105Z",
"structure_string": "Ba2 Zn10\n1.0\n5.401100 0.000000 0.000000\n-0.000000 6.638621 -1.688714\n-0.000000 -0.011510 6.850029\nBa Zn\n2 10\ndirect\n0.750000 0.332739 0.332739 Ba\n0.250000 0.667261 0.667262 Ba\n0.500000 0.205222 0.794778 Zn\n0.000000 0.794778 0.205223 Zn\n0.250000 0.079665 0.079665 Zn\n0.750000 0.920335 0.920336 Zn\n0.250000 0.464935 0.087337 Zn\n0.750000 0.535065 0.912664 Zn\n0.250000 0.087337 0.464935 Zn\n0.750000 0.912663 0.535065 Zn\n0.000000 0.205222 0.794778 Zn\n0.500000 0.794778 0.205223 Zn\n",
"nsites": 12,
"nelements": 2,
"elements": [
"Ba",
"Zn"
],
"chemical_system": "Ba-Zn",
"density": 6.2817157909931245,
"density_atomic": 0.048878110722543604,
"volume": 245.50867090829166,
"volume_molar": 12.320731450085413,
"formula_full": "Ba2 Zn10",
"formula_reduced": "BaZn5",
"formula_anonymous": "AB5",
"energy_above_hull": 0.0,
"spacegroup": 63
},
{
"id": "jvasp-114168",
"created_at": "2022-09-04T14:38:39.595880Z",
"updated_at": "2022-09-04T14:38:39.595903Z",
"structure_string": "Ca2 N2\n1.0\n4.652549 0.155993 0.080613\n-1.029435 -6.220659 0.349183\n1.357902 1.803527 -5.055104\nCa N\n2 2\ndirect\n0.960121 0.854716 0.988441 Ca\n0.395098 0.067330 0.467761 Ca\n0.487127 0.723170 0.964749 N\n0.225116 0.628817 0.933810 N\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Ca",
"N"
],
"chemical_system": "Ca-N",
"density": 1.2546075128824088,
"density_atomic": 0.02793922511816603,
"volume": 143.16789327844342,
"volume_molar": 21.554430140886105,
"formula_full": "Ca2 N2",
"formula_reduced": "CaN",
"formula_anonymous": "AB",
"energy_above_hull": 1.7859268349999995,
"spacegroup": 1
},
{
"id": "jvasp-16382",
"created_at": "2022-09-04T14:38:31.505756Z",
"updated_at": "2022-09-04T14:38:31.505784Z",
"structure_string": "Al1 Re2\n1.0\n2.882848 -0.000000 -0.841931\n-0.245884 2.872343 -0.841931\n-0.018436 -0.020082 5.293407\nAl Re\n1 2\ndirect\n0.000000 0.000000 0.000000 Al\n0.331434 0.331434 0.662867 Re\n0.668567 0.668566 0.337134 Re\n",
"nsites": 3,
"nelements": 2,
"elements": [
"Al",
"Re"
],
"chemical_system": "Al-Re",
"density": 15.164424358262151,
"density_atomic": 0.06859538169717531,
"volume": 43.73472274334669,
"volume_molar": 8.779221882000236,
"formula_full": "Al1 Re2",
"formula_reduced": "AlRe2",
"formula_anonymous": "AB2",
"energy_above_hull": 4.520492933333334,
"spacegroup": 139
}
]
}