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=-chemical_system&page=482",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-chemical_system&page=480",
"results": [
{
"id": "jvasp-86861",
"created_at": "2022-09-04T14:35:51.160344Z",
"updated_at": "2022-09-04T14:35:51.160379Z",
"structure_string": "Ta4 Ni12\n1.0\n4.461309 0.000000 -0.849603\n0.000000 5.125369 0.000000\n0.003372 0.000000 8.661739\nTa Ni\n4 12\ndirect\n0.386739 0.750000 0.622115 Ta\n0.613261 0.250000 0.377886 Ta\n0.209640 0.750000 0.127247 Ta\n0.790360 0.250000 0.872754 Ta\n0.294913 0.998659 0.876829 Ni\n0.885168 0.998273 0.626607 Ni\n0.798499 0.750000 0.873370 Ni\n0.114831 0.498273 0.373394 Ni\n0.630813 0.750000 0.375641 Ni\n0.294913 0.501342 0.876829 Ni\n0.369187 0.250000 0.624359 Ni\n0.705087 0.001341 0.123171 Ni\n0.705087 0.498659 0.123171 Ni\n0.114831 0.001727 0.373394 Ni\n0.201500 0.250000 0.126630 Ni\n0.885168 0.501727 0.626607 Ni\n",
"nsites": 16,
"nelements": 2,
"elements": [
"Ta",
"Ni"
],
"chemical_system": "Ni-Ta",
"density": 11.97255198777097,
"density_atomic": 0.08077840079322718,
"volume": 198.07275017682093,
"volume_molar": 7.455137389282066,
"formula_full": "Ta4 Ni12",
"formula_reduced": "TaNi3",
"formula_anonymous": "AB3",
"energy_above_hull": 2.3585241,
"spacegroup": 11
},
{
"id": "jvasp-86259",
"created_at": "2022-09-04T14:36:15.046792Z",
"updated_at": "2022-09-04T14:36:15.046816Z",
"structure_string": "Ta4 Ni12\n1.0\n4.461310 0.000000 -0.849603\n0.000000 5.125369 0.000000\n0.003372 0.000000 8.661739\nTa Ni\n4 12\ndirect\n0.386739 0.750000 0.622115 Ta\n0.613261 0.250000 0.377886 Ta\n0.209640 0.750000 0.127247 Ta\n0.790360 0.250000 0.872754 Ta\n0.294913 0.998659 0.876829 Ni\n0.885168 0.998273 0.626607 Ni\n0.798499 0.750000 0.873370 Ni\n0.114831 0.498273 0.373394 Ni\n0.630813 0.750000 0.375641 Ni\n0.294913 0.501342 0.876829 Ni\n0.369187 0.250000 0.624359 Ni\n0.705087 0.001341 0.123171 Ni\n0.705087 0.498659 0.123171 Ni\n0.114831 0.001727 0.373394 Ni\n0.201500 0.250000 0.126630 Ni\n0.885168 0.501727 0.626607 Ni\n",
"nsites": 16,
"nelements": 2,
"elements": [
"Ta",
"Ni"
],
"chemical_system": "Ni-Ta",
"density": 11.97254930432946,
"density_atomic": 0.08077838268813864,
"volume": 198.07279457142948,
"volume_molar": 7.4551390602232015,
"formula_full": "Ta4 Ni12",
"formula_reduced": "TaNi3",
"formula_anonymous": "AB3",
"energy_above_hull": 2.3585241,
"spacegroup": 11
},
{
"id": "jvasp-19881",
"created_at": "2022-09-04T14:36:46.298960Z",
"updated_at": "2022-09-04T14:36:46.298986Z",
"structure_string": "Ta2 Ni6\n1.0\n4.256454 0.000000 0.000000\n0.000000 4.547709 0.000000\n0.000000 0.000000 5.112008\nTa Ni\n2 6\ndirect\n0.500000 0.348296 0.000000 Ta\n0.000000 0.651704 0.500000 Ta\n0.000000 0.679092 0.000000 Ni\n0.500000 0.320908 0.500000 Ni\n0.500000 0.840506 0.249900 Ni\n0.000000 0.159494 0.250100 Ni\n0.500000 0.840506 0.750101 Ni\n0.000000 0.159494 0.749900 Ni\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Ta",
"Ni"
],
"chemical_system": "Ni-Ta",
"density": 11.982552246817663,
"density_atomic": 0.08084587220067106,
"volume": 98.95372246269855,
"volume_molar": 7.448915567454307,
"formula_full": "Ta2 Ni6",
"formula_reduced": "TaNi3",
"formula_anonymous": "AB3",
"energy_above_hull": 2.3589741,
"spacegroup": 59
},
{
"id": "jvasp-20100",
"created_at": "2022-09-04T14:36:32.714362Z",
"updated_at": "2022-09-04T14:36:32.714391Z",
"structure_string": "Ta1 Ni2\n1.0\n2.977752 -0.000000 -1.103496\n-0.408934 2.949539 -1.103496\n-0.015527 -0.017828 4.527538\nTa Ni\n1 2\ndirect\n0.000000 0.000000 0.000000 Ta\n0.333928 0.333928 0.667856 Ni\n0.666072 0.666072 0.332142 Ni\n",
"nsites": 3,
"nelements": 2,
"elements": [
"Ta",
"Ni"
],
"chemical_system": "Ni-Ta",
"density": 12.49480705991526,
"density_atomic": 0.07566551120693177,
"volume": 39.64818253583897,
"volume_molar": 7.958897870299868,
"formula_full": "Ta1 Ni2",
"formula_reduced": "TaNi2",
"formula_anonymous": "AB2",
"energy_above_hull": 2.480961333333333,
"spacegroup": 139
},
{
"id": "jvasp-10819",
"created_at": "2022-09-04T14:36:43.734373Z",
"updated_at": "2022-09-04T14:36:43.734391Z",
"structure_string": "Zn1 Ni4 S8\n1.0\n6.757647 0.023572 0.016669\n3.399237 5.887652 0.000000\n3.399237 1.962551 5.550932\nZn Ni S\n1 4 8\ndirect\n0.500000 -0.000000 0.000000 Zn\n0.000001 0.500000 0.500000 Ni\n0.500001 0.500000 0.000000 Ni\n0.500001 0.500000 0.500000 Ni\n0.500001 -0.000000 0.500000 Ni\n0.267442 0.257948 0.257948 S\n0.267443 0.257948 0.716662 S\n0.267443 0.716662 0.257948 S\n0.719435 0.260188 0.260189 S\n0.280567 0.739811 0.739811 S\n0.732559 0.742051 0.283338 S\n0.732559 0.283338 0.742052 S\n0.732559 0.742051 0.742052 S\n",
"nsites": 13,
"nelements": 3,
"elements": [
"Zn",
"Ni",
"S"
],
"chemical_system": "Ni-S-Zn",
"density": 4.19838986833919,
"density_atomic": 0.05904100895092638,
"volume": 220.1859390784687,
"volume_molar": 10.199928603871717,
"formula_full": "Zn1 Ni4 S8",
"formula_reduced": "Zn(NiS2)4",
"formula_anonymous": "AB4C8",
"energy_above_hull": 1.6493707692307693,
"spacegroup": 166
},
{
"id": "jvasp-58487",
"created_at": "2022-09-04T14:38:12.823808Z",
"updated_at": "2022-09-04T14:38:12.823832Z",
"structure_string": "Zn1 Ni4 S8\n1.0\n5.685970 -0.233405 3.926096\n1.935793 5.351395 3.926096\n-0.347588 -0.233405 6.900991\nZn Ni S\n1 4 8\ndirect\n0.499999 0.500001 0.500000 Zn\n0.500000 0.999999 0.500002 Ni\n0.999998 0.500001 0.500002 Ni\n0.500000 0.500000 0.000001 Ni\n0.000000 0.000000 0.000000 Ni\n0.758580 0.269995 0.758581 S\n0.241418 0.241420 0.730006 S\n0.241418 0.730007 0.241420 S\n0.730005 0.241420 0.241420 S\n0.262616 0.262618 0.262617 S\n0.737383 0.737384 0.737384 S\n0.269994 0.758582 0.758581 S\n0.758581 0.758582 0.269995 S\n",
"nsites": 13,
"nelements": 3,
"elements": [
"Zn",
"Ni",
"S"
],
"chemical_system": "Ni-S-Zn",
"density": 4.123986940076523,
"density_atomic": 0.057994697366893104,
"volume": 224.1584246531682,
"volume_molar": 10.383950660009484,
"formula_full": "Zn1 Ni4 S8",
"formula_reduced": "Zn(NiS2)4",
"formula_anonymous": "AB4C8",
"energy_above_hull": 1.6490538461538462,
"spacegroup": 166
},
{
"id": "jvasp-52879",
"created_at": "2022-09-04T14:36:49.279662Z",
"updated_at": "2022-09-04T14:36:49.279690Z",
"structure_string": "V4 Ni1 S8\n1.0\n6.408846 0.017178 0.042765\n-3.064478 5.731476 0.029888\n-1.706793 -2.723367 5.596131\nV Ni S\n4 1 8\ndirect\n0.792506 0.295756 0.514068 V\n0.208348 0.704150 0.484902 V\n0.223591 0.709201 0.976713 V\n0.777300 0.290715 0.022247 V\n0.000463 -0.000036 0.999486 Ni\n0.697335 0.973971 0.668350 S\n0.303543 0.025945 0.330626 S\n0.226289 0.444232 0.667304 S\n0.774566 0.555665 0.331649 S\n0.710303 0.969584 0.170731 S\n0.777016 0.549908 0.828146 S\n0.223865 0.450019 0.170825 S\n0.290585 0.030336 0.828237 S\n",
"nsites": 13,
"nelements": 3,
"elements": [
"V",
"Ni",
"S"
],
"chemical_system": "Ni-S-V",
"density": 4.160230309372349,
"density_atomic": 0.06275690380664736,
"volume": 207.14852408991868,
"volume_molar": 9.595981309967241,
"formula_full": "V4 Ni1 S8",
"formula_reduced": "V4NiS8",
"formula_anonymous": "AB4C8",
"energy_above_hull": 3.106146861538462,
"spacegroup": 2
},
{
"id": "jvasp-53665",
"created_at": "2022-09-04T14:37:30.025027Z",
"updated_at": "2022-09-04T14:37:30.025047Z",
"structure_string": "V3 Ni1 S6\n1.0\n5.134595 0.048827 4.058994\n1.993325 4.732136 4.058994\n0.072795 0.048826 6.544785\nV Ni S\n3 1 6\ndirect\n0.000000 0.000000 0.000000 V\n0.330342 0.330344 0.330342 V\n0.669656 0.669659 0.669655 V\n0.499999 0.500001 0.499999 Ni\n0.416700 0.082990 0.755374 S\n0.755375 0.416702 0.082988 S\n0.082988 0.755376 0.416700 S\n0.917010 0.244626 0.583297 S\n0.244623 0.583300 0.917010 S\n0.583298 0.917012 0.244623 S\n",
"nsites": 10,
"nelements": 3,
"elements": [
"V",
"Ni",
"S"
],
"chemical_system": "Ni-S-V",
"density": 4.288963475732269,
"density_atomic": 0.06394710718528761,
"volume": 156.37923965856444,
"volume_molar": 9.417377931656494,
"formula_full": "V3 Ni1 S6",
"formula_reduced": "V3NiS6",
"formula_anonymous": "AB3C6",
"energy_above_hull": 2.9621545,
"spacegroup": 148
},
{
"id": "jvasp-15476",
"created_at": "2022-09-04T14:36:59.423597Z",
"updated_at": "2022-09-04T14:36:59.423610Z",
"structure_string": "V2 Ni1 S4\n1.0\n3.138828 -0.000000 -0.820882\n-0.634226 5.286231 -2.425109\n-0.023247 -0.061520 6.322560\nV Ni S\n2 1 4\ndirect\n0.741987 0.691733 0.483976 V\n0.258012 0.308267 0.516024 V\n0.000000 0.000000 0.000000 Ni\n0.107821 0.447100 0.215643 S\n0.361944 0.020706 0.723888 S\n0.892178 0.552900 0.784357 S\n0.638054 0.979294 0.276112 S\n",
"nsites": 7,
"nelements": 3,
"elements": [
"V",
"Ni",
"S"
],
"chemical_system": "Ni-S-V",
"density": 4.5982268012541505,
"density_atomic": 0.06711002608116069,
"volume": 104.30632215124498,
"volume_molar": 8.973533630752906,
"formula_full": "V2 Ni1 S4",
"formula_reduced": "V2NiS4",
"formula_anonymous": "AB2C4",
"energy_above_hull": 2.6962244,
"spacegroup": 12
},
{
"id": "jvasp-57505",
"created_at": "2022-09-04T14:37:15.328709Z",
"updated_at": "2022-09-04T14:37:15.328723Z",
"structure_string": "Tl1 Ni2 S2\n1.0\n3.651428 0.000000 -1.039419\n-0.295881 3.639421 -1.039419\n-0.006482 -0.007031 6.910582\nTl Ni S\n1 2 2\ndirect\n0.000000 0.000000 0.000000 Tl\n0.250001 0.750000 0.500000 Ni\n0.750001 0.250000 0.500000 Ni\n0.345794 0.345793 0.691585 S\n0.654208 0.654207 0.308414 S\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Tl",
"Ni",
"S"
],
"chemical_system": "Ni-S-Tl",
"density": 6.981789976804753,
"density_atomic": 0.054476951433292356,
"volume": 91.7819347164196,
"volume_molar": 11.05447460174819,
"formula_full": "Tl1 Ni2 S2",
"formula_reduced": "Tl(NiS)2",
"formula_anonymous": "AB2C2",
"energy_above_hull": 1.03744348,
"spacegroup": 139
},
{
"id": "jvasp-34327",
"created_at": "2022-09-04T14:37:11.233375Z",
"updated_at": "2022-09-04T14:37:11.233394Z",
"structure_string": "Tl2 Ni3 S2\n1.0\n4.825805 -0.011051 2.935257\n1.644832 4.536852 2.935257\n-0.015800 -0.011051 5.648352\nTl Ni S\n2 3 2\ndirect\n0.000000 0.000000 0.000000 Tl\n0.499999 0.500000 0.500001 Tl\n-0.000000 0.500000 0.500000 Ni\n0.499999 0.500000 0.000001 Ni\n0.499999 0.000000 0.500000 Ni\n0.772594 0.772595 0.772596 S\n0.227405 0.227405 0.227405 S\n",
"nsites": 7,
"nelements": 3,
"elements": [
"Tl",
"Ni",
"S"
],
"chemical_system": "Ni-S-Tl",
"density": 8.685022510297731,
"density_atomic": 0.0564144968744634,
"volume": 124.08158164694404,
"volume_molar": 10.674810720018998,
"formula_full": "Tl2 Ni3 S2",
"formula_reduced": "Tl2Ni3S2",
"formula_anonymous": "A2B2C3",
"energy_above_hull": 0.8702946285714288,
"spacegroup": 166
},
{
"id": "jvasp-35441",
"created_at": "2022-09-04T14:37:50.619094Z",
"updated_at": "2022-09-04T14:37:50.619104Z",
"structure_string": "Ti2 Ni1 S4\n1.0\n0.000000 3.403173 0.000000\n0.004991 0.000000 5.875446\n5.634996 -1.701587 -2.923468\nTi Ni S\n2 1 4\ndirect\n0.256174 0.262598 0.512350 Ti\n0.743824 0.737402 0.487651 Ti\n0.000000 0.000000 0.000000 Ni\n0.118371 0.448155 0.236745 S\n0.881627 0.551845 0.763256 S\n0.376621 0.040323 0.753243 S\n0.623377 0.959678 0.246757 S\n",
"nsites": 7,
"nelements": 3,
"elements": [
"Ti",
"Ni",
"S"
],
"chemical_system": "Ni-S-Ti",
"density": 4.164335542162022,
"density_atomic": 0.06209951476721629,
"volume": 112.7222978511171,
"volume_molar": 9.697564920715326,
"formula_full": "Ti2 Ni1 S4",
"formula_reduced": "Ti2NiS4",
"formula_anonymous": "AB2C4",
"energy_above_hull": 2.471485580952381,
"spacegroup": 12
}
]
}