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=formula_anonymous&page=981",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=formula_anonymous&page=979",
"results": [
{
"id": "jvasp-110605",
"created_at": "2022-09-04T14:38:38.951851Z",
"updated_at": "2022-09-04T14:38:38.951876Z",
"structure_string": "Ce1 Ni2 Sb2\n1.0\n4.226631 -0.040566 -3.883597\n-0.842278 4.142055 -3.883597\n0.033473 0.040566 5.739827\nCe Ni Sb\n1 2 2\ndirect\n0.000000 0.000000 0.000000 Ce\n0.629251 0.629252 -0.000001 Ni\n0.370748 0.370749 -0.000000 Ni\n0.749999 0.250000 0.499999 Sb\n0.249999 0.750001 0.500000 Sb\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Ce",
"Ni",
"Sb"
],
"chemical_system": "Ce-Ni-Sb",
"density": 8.186004589138978,
"density_atomic": 0.04919663527771288,
"volume": 101.63296680301845,
"volume_molar": 12.240960638883687,
"formula_full": "Ce1 Ni2 Sb2",
"formula_reduced": "Ce(NiSb)2",
"formula_anonymous": "AB2C2",
"energy_above_hull": 1.5044205000000002,
"spacegroup": 139
},
{
"id": "jvasp-59151",
"created_at": "2022-09-04T14:38:34.014706Z",
"updated_at": "2022-09-04T14:38:34.014738Z",
"structure_string": "Cd8 P4 Cl8\n1.0\n0.000000 7.805580 -0.016001\n9.042126 0.000000 0.000000\n0.000000 -3.987420 -6.972719\nCd P Cl\n8 4 8\ndirect\n0.432873 0.423802 0.727337 Cd\n0.567127 0.923802 0.772663 Cd\n0.567127 0.576199 0.272662 Cd\n0.432873 0.076198 0.227337 Cd\n0.973212 0.296971 0.795238 Cd\n0.026788 0.796972 0.704762 Cd\n0.026788 0.703029 0.204762 Cd\n0.973212 0.203029 0.295238 Cd\n0.068213 0.391725 0.557590 P\n0.931787 0.608275 0.442410 P\n0.068213 0.108275 0.057590 P\n0.931787 0.891726 0.942410 P\n0.240380 0.033162 0.694285 Cl\n0.240380 0.466839 0.194285 Cl\n0.759620 0.533162 0.805715 Cl\n0.759620 0.966839 0.305715 Cl\n0.580642 0.199071 0.575032 Cl\n0.419358 0.699071 0.924968 Cl\n0.419358 0.800929 0.424968 Cl\n0.580642 0.300929 0.075032 Cl\n",
"nsites": 20,
"nelements": 3,
"elements": [
"Cd",
"P",
"Cl"
],
"chemical_system": "Cd-Cl-P",
"density": 4.404269149003444,
"density_atomic": 0.04059226464990717,
"volume": 492.7047104292501,
"volume_molar": 14.835685596599921,
"formula_full": "Cd8 P4 Cl8",
"formula_reduced": "Cd2PCl2",
"formula_anonymous": "AB2C2",
"energy_above_hull": 0.1908343666666668,
"spacegroup": 14
},
{
"id": "jvasp-110394",
"created_at": "2022-09-04T14:38:38.524600Z",
"updated_at": "2022-09-04T14:38:38.524624Z",
"structure_string": "Zn2 O4 F4\n1.0\n3.064768 -0.127114 -0.863367\n-1.196180 6.433440 -4.362855\n-0.549210 -3.052721 9.479222\nZn O F\n2 4 4\ndirect\n0.500016 0.250002 0.250001 Zn\n0.499985 0.749999 0.749999 Zn\n0.458901 0.843724 0.272507 O\n0.541124 0.656278 0.227495 O\n0.541100 0.156277 0.727494 O\n0.458877 0.343724 0.772506 O\n0.161094 0.296949 0.419941 F\n0.838909 0.203052 0.080058 F\n0.838907 0.703052 0.580059 F\n0.161092 0.796950 0.919942 F\n",
"nsites": 10,
"nelements": 3,
"elements": [
"Zn",
"O",
"F"
],
"chemical_system": "F-O-Zn",
"density": 3.2554486128701123,
"density_atomic": 0.07239328968067349,
"volume": 138.13434980106527,
"volume_molar": 8.318644982930929,
"formula_full": "Zn2 O4 F4",
"formula_reduced": "Zn(OF)2",
"formula_anonymous": "AB2C2",
"energy_above_hull": 0.3526395929999996,
"spacegroup": 12
},
{
"id": "jvasp-110476",
"created_at": "2022-09-04T14:38:38.705216Z",
"updated_at": "2022-09-04T14:38:38.705245Z",
"structure_string": "Th1 Ni2 H2\n1.0\n4.322604 0.000000 0.000000\n-2.161302 3.743485 -0.000000\n-0.000000 0.000000 3.570787\nTh Ni H\n1 2 2\ndirect\n0.000000 0.000000 0.000000 Th\n0.333333 0.666668 0.500000 Ni\n0.666667 0.333333 0.500000 Ni\n0.666667 0.333333 0.000000 H\n0.333333 0.666668 0.000000 H\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Th",
"Ni",
"H"
],
"chemical_system": "H-Ni-Th",
"density": 10.09986825808918,
"density_atomic": 0.08653354805804263,
"volume": 57.78105847048171,
"volume_molar": 6.959313347420624,
"formula_full": "Th1 Ni2 H2",
"formula_reduced": "Th(NiH)2",
"formula_anonymous": "AB2C2",
"energy_above_hull": 2.17281608,
"spacegroup": 191
},
{
"id": "jvasp-110938",
"created_at": "2022-09-04T14:38:38.461441Z",
"updated_at": "2022-09-04T14:38:38.461461Z",
"structure_string": "Y1 P2 Pd2\n1.0\n3.836975 -0.005190 -4.286725\n-0.564246 3.795265 -4.286725\n0.004482 0.005190 5.753118\nY P Pd\n1 2 2\ndirect\n0.000000 0.000000 0.000000 Y\n0.389074 0.389074 0.000000 P\n0.610926 0.610925 0.000001 P\n0.750000 0.250000 0.500001 Pd\n0.249999 0.749999 0.500000 Pd\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Y",
"P",
"Pd"
],
"chemical_system": "P-Pd-Y",
"density": 7.195352749841253,
"density_atomic": 0.059571372741549465,
"volume": 83.9329323783172,
"volume_molar": 10.109118663635757,
"formula_full": "Y1 P2 Pd2",
"formula_reduced": "Y(PPd)2",
"formula_anonymous": "AB2C2",
"energy_above_hull": 2.41217557,
"spacegroup": 139
},
{
"id": "jvasp-110914",
"created_at": "2022-09-04T14:38:38.315551Z",
"updated_at": "2022-09-04T14:38:38.315571Z",
"structure_string": "Sm4 Cd2 Rh4\n1.0\n7.592896 0.000000 0.000000\n0.000000 7.592896 0.000000\n-0.000000 -0.000000 3.819017\nSm Cd Rh\n4 2 4\ndirect\n0.666229 0.166229 0.500000 Sm\n0.333772 0.833772 0.500000 Sm\n0.166229 0.333772 0.500000 Sm\n0.833772 0.666229 0.500000 Sm\n0.000000 0.000000 0.000000 Cd\n0.500000 0.500000 -0.000000 Cd\n0.135216 0.635217 -0.000000 Rh\n0.864784 0.364784 -0.000000 Rh\n0.635217 0.864784 -0.000000 Rh\n0.364784 0.135216 -0.000000 Rh\n",
"nsites": 10,
"nelements": 3,
"elements": [
"Sm",
"Cd",
"Rh"
],
"chemical_system": "Cd-Rh-Sm",
"density": 9.336036752539863,
"density_atomic": 0.045418575152241875,
"volume": 220.17423414275464,
"volume_molar": 13.259202297328663,
"formula_full": "Sm4 Cd2 Rh4",
"formula_reduced": "Sm2CdRh2",
"formula_anonymous": "AB2C2",
"energy_above_hull": 1.3403447,
"spacegroup": 127
},
{
"id": "jvasp-115302",
"created_at": "2022-09-04T14:38:44.717794Z",
"updated_at": "2022-09-04T14:38:44.717806Z",
"structure_string": "Rb2 Pd1 O2\n1.0\n-2.076851 2.076851 6.787700\n2.076851 -2.076851 6.787700\n2.076851 2.076851 -6.787700\nRb Pd O\n2 1 2\ndirect\n0.348681 0.348681 0.000000 Rb\n0.651318 0.651318 0.000000 Rb\n0.000000 0.000000 0.000000 Pd\n0.862163 0.862163 0.000000 O\n0.137837 0.137837 0.000000 O\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Rb",
"Pd",
"O"
],
"chemical_system": "O-Pd-Rb",
"density": 4.386438900337681,
"density_atomic": 0.042694968137032885,
"volume": 117.10981921691811,
"volume_molar": 14.105036314048675,
"formula_full": "Rb2 Pd1 O2",
"formula_reduced": "Rb2PdO2",
"formula_anonymous": "AB2C2",
"energy_above_hull": 0.7695705399999995,
"spacegroup": 139
},
{
"id": "jvasp-111125",
"created_at": "2022-09-04T14:38:38.255558Z",
"updated_at": "2022-09-04T14:38:38.255581Z",
"structure_string": "Na2 Cr1 N2\n1.0\n2.961391 -0.000089 -0.008665\n-1.480628 2.564690 -0.000000\n0.017882 0.010323 8.735543\nNa Cr N\n2 1 2\ndirect\n0.667771 0.333885 0.302537 Na\n0.332227 0.666113 0.697462 Na\n0.000000 0.000000 0.000000 Cr\n0.666166 0.333083 0.879775 N\n0.333832 0.666915 0.120225 N\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Na",
"Cr",
"N"
],
"chemical_system": "Cr-N-Na",
"density": 3.153300718251532,
"density_atomic": 0.0753621942334244,
"volume": 66.34626354579278,
"volume_molar": 7.9909307594564165,
"formula_full": "Na2 Cr1 N2",
"formula_reduced": "Na2CrN2",
"formula_anonymous": "AB2C2",
"energy_above_hull": 2.86598838,
"spacegroup": 164
},
{
"id": "jvasp-111003",
"created_at": "2022-09-04T14:38:36.539069Z",
"updated_at": "2022-09-04T14:38:36.539088Z",
"structure_string": "Sr1 Si2 Pt2\n1.0\n4.040378 -0.024372 -4.373411\n-0.636114 3.990064 -4.373411\n0.020921 0.024372 5.954069\nSr Si Pt\n1 2 2\ndirect\n0.000000 0.000000 0.000000 Sr\n0.250001 0.749999 0.500000 Si\n0.750000 0.250000 0.500000 Si\n0.640188 0.640187 0.000001 Pt\n0.359813 0.359812 0.000000 Pt\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Sr",
"Si",
"Pt"
],
"chemical_system": "Pt-Si-Sr",
"density": 9.163382423616605,
"density_atomic": 0.05167361053170679,
"volume": 96.76118909732489,
"volume_molar": 11.654190016981357,
"formula_full": "Sr1 Si2 Pt2",
"formula_reduced": "Sr(SiPt)2",
"formula_anonymous": "AB2C2",
"energy_above_hull": 2.156075262,
"spacegroup": 139
},
{
"id": "jvasp-116348",
"created_at": "2022-09-04T14:38:42.094292Z",
"updated_at": "2022-09-04T14:38:42.094324Z",
"structure_string": "Ti2 Zn1 N2\n1.0\n3.116180 0.000000 0.000000\n0.000000 3.116180 0.000000\n-0.000000 0.000000 7.628047\nTi Zn N\n2 1 2\ndirect\n0.500000 0.500000 0.187565 Ti\n0.500000 0.500000 0.812435 Ti\n0.000000 0.000000 0.500000 Zn\n0.000000 0.500000 0.670332 N\n0.500000 0.000000 0.329668 N\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Ti",
"Zn",
"N"
],
"chemical_system": "N-Ti-Zn",
"density": 4.240447643680556,
"density_atomic": 0.06750121223622231,
"volume": 74.07274379758344,
"volume_molar": 8.92152979256929,
"formula_full": "Ti2 Zn1 N2",
"formula_reduced": "Ti2ZnN2",
"formula_anonymous": "AB2C2",
"energy_above_hull": 3.402798713333333,
"spacegroup": 115
},
{
"id": "jvasp-115493",
"created_at": "2022-09-04T14:38:42.368857Z",
"updated_at": "2022-09-04T14:38:42.368883Z",
"structure_string": "Rb2 B1 O2\n1.0\n-2.018827 2.018827 8.035563\n2.018827 -2.018827 8.035563\n2.018827 2.018827 -8.035563\nRb B O\n2 1 2\ndirect\n0.365306 0.365306 0.000000 Rb\n0.634693 0.634693 0.000000 Rb\n0.000000 0.000000 0.000000 B\n0.920730 0.920730 0.000000 O\n0.079269 0.079269 0.000000 O\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Rb",
"B",
"O"
],
"chemical_system": "B-O-Rb",
"density": 2.7093890049059786,
"density_atomic": 0.03816765639583052,
"volume": 131.0009697254088,
"volume_molar": 15.778125587658208,
"formula_full": "Rb2 B1 O2",
"formula_reduced": "Rb2BO2",
"formula_anonymous": "AB2C2",
"energy_above_hull": 1.2299119166666663,
"spacegroup": 139
},
{
"id": "jvasp-116792",
"created_at": "2022-09-04T14:38:44.801794Z",
"updated_at": "2022-09-04T14:38:44.801811Z",
"structure_string": "K8 Co4 O8\n1.0\n6.462618 0.074026 -0.000020\n-3.117953 6.061410 -0.000002\n-0.000038 -0.000009 9.527650\nK Co O\n8 4 8\ndirect\n0.743677 0.357575 0.235801 K\n0.256322 0.142419 0.735800 K\n0.743671 0.857576 0.264203 K\n0.256331 0.642428 0.764201 K\n0.213324 0.394932 0.412114 K\n0.786677 0.105070 0.912113 K\n0.786683 0.605123 0.587882 K\n0.213320 0.894879 0.087884 K\n0.695881 0.591355 0.932578 Co\n0.304118 0.908647 0.432577 Co\n0.695890 0.091409 0.567422 Co\n0.304112 0.408592 0.067422 Co\n0.492223 0.199207 0.482220 O\n0.492220 0.699156 0.017782 O\n0.507779 0.300794 0.982219 O\n0.507783 0.800847 0.517783 O\n0.952603 0.776982 0.850415 O\n0.047391 0.723014 0.350414 O\n0.047380 0.222991 0.149585 O\n0.952624 0.277013 0.649586 O\n",
"nsites": 20,
"nelements": 3,
"elements": [
"K",
"Co",
"O"
],
"chemical_system": "Co-K-O",
"density": 2.992311359876349,
"density_atomic": 0.05327342846178602,
"volume": 375.4216797656708,
"volume_molar": 11.304210999522565,
"formula_full": "K8 Co4 O8",
"formula_reduced": "K2CoO2",
"formula_anonymous": "AB2C2",
"energy_above_hull": 1.0661027800000005,
"spacegroup": 14
}
]
}