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=1016",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=density_atomic&page=1014",
"results": [
{
"id": "jvasp-1483",
"created_at": "2022-09-04T14:36:42.023301Z",
"updated_at": "2022-09-04T14:36:42.023318Z",
"structure_string": "K1 Er1 S2\n1.0\n3.858869 0.004229 6.590354\n1.790729 3.418213 6.590354\n0.006980 0.004229 7.636988\nK Er S\n1 1 2\ndirect\n0.500000 0.500000 0.499999 K\n0.000000 0.000000 0.000000 Er\n0.734227 0.734227 0.734226 S\n0.265773 0.265773 0.265773 S\n",
"nsites": 4,
"nelements": 3,
"elements": [
"K",
"Er",
"S"
],
"chemical_system": "Er-K-S",
"density": 4.47086141114671,
"density_atomic": 0.03981577951450162,
"volume": 100.4626821017815,
"volume_molar": 15.12501031860152,
"formula_full": "K1 Er1 S2",
"formula_reduced": "KErS2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.5400195,
"spacegroup": 166
},
{
"id": "jvasp-56798",
"created_at": "2022-09-04T14:37:43.488708Z",
"updated_at": "2022-09-04T14:37:43.488733Z",
"structure_string": "Ho1 Sb1 Pd1\n1.0\n4.105700 0.000000 2.370427\n1.368567 3.870891 2.370427\n0.000000 0.000000 4.740854\nHo Sb Pd\n1 1 1\ndirect\n0.000000 0.000000 0.000000 Ho\n0.250000 0.250000 0.250000 Sb\n0.500000 0.500000 0.500000 Pd\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Ho",
"Sb",
"Pd"
],
"chemical_system": "Ho-Pd-Sb",
"density": 8.663807750923523,
"density_atomic": 0.039816815146194263,
"volume": 75.3450518075086,
"volume_molar": 15.124616918476972,
"formula_full": "Ho1 Sb1 Pd1",
"formula_reduced": "HoSbPd",
"formula_anonymous": "ABC",
"energy_above_hull": 1.1483657888888883,
"spacegroup": 216
},
{
"id": "jvasp-37093",
"created_at": "2022-09-04T14:38:09.847975Z",
"updated_at": "2022-09-04T14:38:09.848010Z",
"structure_string": "Sm2 Au2\n1.0\n-3.835959 0.000000 0.000000\n0.000000 -0.000000 -4.705211\n-1.917979 -5.565299 -0.000000\nSm Au\n2 2\ndirect\n0.137283 0.750000 0.725433 Sm\n0.862717 0.250000 0.274567 Sm\n0.410487 0.750000 0.179026 Au\n0.589513 0.250000 0.820974 Au\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Sm",
"Au"
],
"chemical_system": "Au-Sm",
"density": 11.483533376014444,
"density_atomic": 0.0398215746267402,
"volume": 100.44806207422042,
"volume_molar": 15.122809222004324,
"formula_full": "Sm2 Au2",
"formula_reduced": "SmAu",
"formula_anonymous": "AB",
"energy_above_hull": 0.1992932224999999,
"spacegroup": 63
},
{
"id": "jvasp-20655",
"created_at": "2022-09-04T14:38:10.863547Z",
"updated_at": "2022-09-04T14:38:10.863574Z",
"structure_string": "Pu1 Se1\n1.0\n3.586514 0.000000 2.070675\n1.195504 3.381398 2.070675\n0.000000 0.000000 4.141350\nPu Se\n1 1\ndirect\n0.000000 0.000000 0.000000 Pu\n0.499999 0.500000 0.499999 Se\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Pu",
"Se"
],
"chemical_system": "Pu-Se",
"density": 10.677930164423092,
"density_atomic": 0.039821648809653144,
"volume": 50.223937475817955,
"volume_molar": 15.122781050040741,
"formula_full": "Pu1 Se1",
"formula_reduced": "PuSe",
"formula_anonymous": "AB",
"energy_above_hull": 2.3341966833333334,
"spacegroup": 225
},
{
"id": "jvasp-20749",
"created_at": "2022-09-04T14:37:33.094530Z",
"updated_at": "2022-09-04T14:37:33.094557Z",
"structure_string": "Pu1 Se1\n1.0\n3.586514 0.000000 2.070675\n1.195504 3.381398 2.070675\n0.000000 0.000000 4.141350\nPu Se\n1 1\ndirect\n0.000000 0.000000 0.000000 Pu\n0.499999 0.500000 0.499999 Se\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Pu",
"Se"
],
"chemical_system": "Pu-Se",
"density": 10.677930164423092,
"density_atomic": 0.039821648809653144,
"volume": 50.223937475817955,
"volume_molar": 15.122781050040741,
"formula_full": "Pu1 Se1",
"formula_reduced": "PuSe",
"formula_anonymous": "AB",
"energy_above_hull": 2.334191683333333,
"spacegroup": 225
},
{
"id": "jvasp-106617",
"created_at": "2022-09-04T14:36:52.823720Z",
"updated_at": "2022-09-04T14:36:52.823754Z",
"structure_string": "Yb1 Mg3\n1.0\n4.518713 -0.000000 2.608880\n1.506238 4.260284 2.608880\n-0.000000 -0.000000 5.217761\nYb Mg\n1 3\ndirect\n0.000000 0.000000 0.000000 Yb\n0.250000 0.250000 0.250000 Mg\n0.500000 0.500000 0.500000 Mg\n0.750000 0.749999 0.750000 Mg\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Yb",
"Mg"
],
"chemical_system": "Mg-Yb",
"density": 4.0659989409844774,
"density_atomic": 0.03982194785400793,
"volume": 100.44712063469329,
"volume_molar": 15.12266748497059,
"formula_full": "Yb1 Mg3",
"formula_reduced": "YbMg3",
"formula_anonymous": "AB3",
"energy_above_hull": 0.000535,
"spacegroup": 225
},
{
"id": "jvasp-29982",
"created_at": "2022-09-04T14:38:05.377025Z",
"updated_at": "2022-09-04T14:38:05.377042Z",
"structure_string": "Re12 Se12 Cl12\n1.0\n9.031575 0.044655 -0.000000\n-1.806067 8.849263 -0.000000\n-0.000000 -0.000000 11.299794\nRe Se Cl\n12 12 12\ndirect\n0.130284 0.869715 0.000000 Re\n0.863124 0.136875 0.000000 Re\n0.929777 0.936056 0.150474 Re\n0.848797 0.855849 0.930694 Re\n0.651202 0.644149 0.430694 Re\n0.570222 0.563943 0.650474 Re\n0.636875 0.363124 0.500000 Re\n0.355850 0.348797 0.569305 Re\n0.369715 0.630284 0.500000 Re\n0.144150 0.151202 0.069305 Re\n0.063943 0.070222 0.849526 Re\n0.436056 0.429777 0.349526 Re\n0.551001 0.294258 0.711906 Se\n0.948998 0.205741 0.211906 Se\n0.794258 0.051001 0.788093 Se\n0.839931 0.576646 0.579825 Se\n0.705741 0.448998 0.288093 Se\n0.660067 0.923353 0.079825 Se\n0.423353 0.160068 0.420174 Se\n0.453578 0.703664 0.288341 Se\n0.296335 0.546421 0.711659 Se\n0.076646 0.339932 0.920174 Se\n0.203664 0.953578 0.211659 Se\n0.046421 0.796335 0.788341 Se\n0.856088 0.846678 0.355434 Cl\n0.692221 0.307778 0.000000 Cl\n0.643911 0.653321 0.855434 Cl\n0.573906 0.830206 0.576815 Cl\n0.330206 0.073906 0.923184 Cl\n0.299092 0.700907 0.000000 Cl\n0.807778 0.192221 0.500000 Cl\n0.153321 0.143911 0.644565 Cl\n0.169793 0.426093 0.423185 Cl\n0.200907 0.799092 0.500000 Cl\n0.346678 0.356088 0.144566 Cl\n0.926092 0.669793 0.076815 Cl\n",
"nsites": 36,
"nelements": 3,
"elements": [
"Re",
"Se",
"Cl"
],
"chemical_system": "Cl-Re-Se",
"density": 6.626269080380971,
"density_atomic": 0.03982202627517801,
"volume": 904.0223054254684,
"volume_molar": 15.122637704033007,
"formula_full": "Re12 Se12 Cl12",
"formula_reduced": "ReSeCl",
"formula_anonymous": "ABC",
"energy_above_hull": 2.316345144722222,
"spacegroup": 20
},
{
"id": "jvasp-18849",
"created_at": "2022-09-04T14:36:37.562003Z",
"updated_at": "2022-09-04T14:36:37.562028Z",
"structure_string": "Ce2 Ag2 Sn2\n1.0\n2.411880 -4.177499 0.000000\n2.411880 4.177499 -0.000000\n0.000000 -0.000000 7.476934\nCe Ag Sn\n2 2 2\ndirect\n0.000000 0.000000 0.730831 Ce\n0.000000 0.000000 0.230832 Ce\n0.666667 0.333333 0.531500 Ag\n0.333333 0.666667 0.031500 Ag\n0.333333 0.666667 0.455668 Sn\n0.666667 0.333333 0.955668 Sn\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Ce",
"Ag",
"Sn"
],
"chemical_system": "Ag-Ce-Sn",
"density": 8.082720111749325,
"density_atomic": 0.039822237373914146,
"volume": 150.66958552987646,
"volume_molar": 15.122557538529588,
"formula_full": "Ce2 Ag2 Sn2",
"formula_reduced": "CeAgSn",
"formula_anonymous": "ABC",
"energy_above_hull": 0.5213081533333334,
"spacegroup": 186
},
{
"id": "jvasp-41320",
"created_at": "2022-09-04T14:37:41.062874Z",
"updated_at": "2022-09-04T14:37:41.062892Z",
"structure_string": "Na1 Sr1 Au2\n1.0\n0.000582 3.689724 3.689724\n3.689724 0.000582 3.689724\n3.689724 3.689724 0.000582\nNa Sr Au\n1 1 2\ndirect\n0.249996 0.249996 0.249996 Na\n0.750002 0.750002 0.750002 Sr\n0.500056 0.500056 0.500056 Au\n-0.000056 -0.000056 -0.000056 Au\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Na",
"Sr",
"Au"
],
"chemical_system": "Au-Na-Sr",
"density": 8.341388162290635,
"density_atomic": 0.039824572253153626,
"volume": 100.4405012707512,
"volume_molar": 15.121670916435566,
"formula_full": "Na1 Sr1 Au2",
"formula_reduced": "NaSrAu2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-79766",
"created_at": "2022-09-04T14:37:17.563198Z",
"updated_at": "2022-09-04T14:37:17.563218Z",
"structure_string": "Ca2 Au2\n1.0\n3.713385 0.000000 -1.328101\n-0.000000 4.613700 0.000000\n0.002106 -0.000000 5.861272\nCa Au\n2 2\ndirect\n0.861569 0.250000 0.723135 Ca\n0.138433 0.750000 0.276865 Ca\n0.584976 0.250000 0.169950 Au\n0.415027 0.750000 0.830051 Au\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Ca",
"Au"
],
"chemical_system": "Au-Ca",
"density": 7.838664738381861,
"density_atomic": 0.03982841086841975,
"volume": 100.43082093369763,
"volume_molar": 15.120213507627046,
"formula_full": "Ca2 Au2",
"formula_reduced": "CaAu",
"formula_anonymous": "AB",
"energy_above_hull": 3.4999999999951736e-05,
"spacegroup": 63
},
{
"id": "jvasp-103094",
"created_at": "2022-09-04T14:36:31.270445Z",
"updated_at": "2022-09-04T14:36:31.270474Z",
"structure_string": "Ge2 Te1 Se1\n1.0\n3.964720 -0.001835 5.965771\n1.800216 3.532453 5.965771\n-0.002995 -0.001835 7.163060\nGe Te Se\n2 1 1\ndirect\n0.244647 0.244648 0.244647 Ge\n0.755352 0.755354 0.755352 Ge\n0.000000 0.000000 0.000000 Te\n0.500000 0.500001 0.499999 Se\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ge",
"Te",
"Se"
],
"chemical_system": "Ge-Se-Te",
"density": 5.817396660056997,
"density_atomic": 0.03982853746671649,
"volume": 100.43050170603627,
"volume_molar": 15.120165446779263,
"formula_full": "Ge2 Te1 Se1",
"formula_reduced": "Ge2TeSe",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.9345357583333332,
"spacegroup": 166
},
{
"id": "jvasp-42093",
"created_at": "2022-09-04T14:37:41.389212Z",
"updated_at": "2022-09-04T14:37:41.389241Z",
"structure_string": "Pa4 S6\n1.0\n-6.788324 0.000000 -0.000000\n3.394161 -5.878862 -0.000000\n-3.394161 1.959621 6.291057\nPa S\n4 6\ndirect\n0.658008 0.341991 0.025972 Pa\n0.841991 0.158009 0.474028 Pa\n0.158009 0.841992 0.525972 Pa\n0.341989 0.658009 0.974028 Pa\n0.250001 0.065190 0.249999 S\n0.934808 0.434809 0.249999 S\n0.565191 0.750000 0.249999 S\n0.434809 0.250000 0.749999 S\n0.065189 0.565191 0.749999 S\n0.750000 0.934810 0.749999 S\n",
"nsites": 10,
"nelements": 2,
"elements": [
"Pa",
"S"
],
"chemical_system": "Pa-S",
"density": 7.384845517811796,
"density_atomic": 0.039830939616113364,
"volume": 251.06111220018926,
"volume_molar": 15.11925357031693,
"formula_full": "Pa4 S6",
"formula_reduced": "Pa2S3",
"formula_anonymous": "A2B3",
"energy_above_hull": 2.93359324,
"spacegroup": 167
}
]
}