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=52",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=energy_above_hull&page=50",
"results": [
{
"id": "jvasp-64862",
"created_at": "2022-09-04T14:35:44.503988Z",
"updated_at": "2022-09-04T14:35:44.504018Z",
"structure_string": "Ba4 Tl1 Zn1\n1.0\n0.000000 5.073173 5.073173\n5.073173 -0.000000 5.073173\n5.073173 5.073173 0.000000\nBa Tl Zn\n4 1 1\ndirect\n0.126026 0.624658 0.624658 Ba\n0.624658 0.624658 0.624658 Ba\n0.624658 0.126026 0.624658 Ba\n0.624658 0.624658 0.126026 Ba\n0.250000 0.250000 0.250000 Tl\n0.000000 0.000000 0.000000 Zn\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Ba",
"Tl",
"Zn"
],
"chemical_system": "Ba-Tl-Zn",
"density": 5.20855398120386,
"density_atomic": 0.022976413444146717,
"volume": 261.1373622164912,
"volume_molar": 26.210099216046935,
"formula_full": "Ba4 Tl1 Zn1",
"formula_reduced": "Ba4TlZn",
"formula_anonymous": "ABC4",
"energy_above_hull": 0.0,
"spacegroup": 216
},
{
"id": "jvasp-93180",
"created_at": "2022-09-04T14:35:42.597853Z",
"updated_at": "2022-09-04T14:35:42.597865Z",
"structure_string": "K1 Mg6 Sb1\n1.0\n7.509646 -0.591489 0.000000\n-4.267067 6.207799 0.000000\n0.000000 0.000000 4.980470\nK Mg Sb\n1 6 1\ndirect\n0.205415 0.294585 0.250000 K\n0.161164 0.797343 0.250000 Mg\n0.702657 0.338836 0.250000 Mg\n0.632149 0.867851 0.250000 Mg\n0.308786 0.679044 0.750000 Mg\n0.820956 0.191214 0.750000 Mg\n0.790167 0.709833 0.750000 Mg\n0.378707 0.121293 0.750000 Sb\n",
"nsites": 8,
"nelements": 3,
"elements": [
"K",
"Mg",
"Sb"
],
"chemical_system": "K-Mg-Sb",
"density": 2.31895355171082,
"density_atomic": 0.03642803382882367,
"volume": 219.61108407860328,
"volume_molar": 16.5316107597193,
"formula_full": "K1 Mg6 Sb1",
"formula_reduced": "KMg6Sb",
"formula_anonymous": "ABC6",
"energy_above_hull": 0.0,
"spacegroup": 38
},
{
"id": "jvasp-86436",
"created_at": "2022-09-04T14:35:41.216418Z",
"updated_at": "2022-09-04T14:35:41.216451Z",
"structure_string": "Li1 Sb1 F6\n1.0\n4.509030 0.056403 3.028820\n1.643489 4.199223 3.028820\n0.081545 0.056403 5.431247\nLi Sb F\n1 1 6\ndirect\n0.500000 0.499999 0.500001 Li\n0.000000 0.000000 0.000000 Sb\n0.623259 0.891282 0.243011 F\n0.891283 0.243009 0.623259 F\n0.756990 0.376741 0.108717 F\n0.243010 0.623257 0.891285 F\n0.108717 0.756989 0.376742 F\n0.376741 0.108716 0.756991 F\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Li",
"Sb",
"F"
],
"chemical_system": "F-Li-Sb",
"density": 3.9971566651595967,
"density_atomic": 0.07934830218564845,
"volume": 100.82131286543068,
"volume_molar": 7.5895017210452815,
"formula_full": "Li1 Sb1 F6",
"formula_reduced": "LiSbF6",
"formula_anonymous": "ABC6",
"energy_above_hull": 0.0,
"spacegroup": 148
},
{
"id": "jvasp-94825",
"created_at": "2022-09-04T14:35:42.294901Z",
"updated_at": "2022-09-04T14:35:42.294918Z",
"structure_string": "Ca1 Rh1 F6\n1.0\n4.662173 0.038934 3.383584\n1.746345 4.322922 3.383583\n0.057202 0.038935 5.760315\nCa Rh F\n1 1 6\ndirect\n0.500000 0.499999 0.499999 Ca\n0.000000 0.000000 0.000000 Rh\n0.384118 0.066403 0.779716 F\n0.066405 0.779716 0.384117 F\n0.220284 0.615880 0.933595 F\n0.933596 0.220282 0.615881 F\n0.615883 0.933595 0.220282 F\n0.779717 0.384117 0.066403 F\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Ca",
"Rh",
"F"
],
"chemical_system": "Ca-F-Rh",
"density": 3.727107288668332,
"density_atomic": 0.06987530811722693,
"volume": 114.48965615405557,
"volume_molar": 8.618410311546537,
"formula_full": "Ca1 Rh1 F6",
"formula_reduced": "CaRhF6",
"formula_anonymous": "ABC6",
"energy_above_hull": 0.0,
"spacegroup": 148
},
{
"id": "jvasp-3798",
"created_at": "2022-09-04T14:35:45.745424Z",
"updated_at": "2022-09-04T14:35:45.745449Z",
"structure_string": "Na1 Bi1 F6\n1.0\n4.824248 0.092911 3.592553\n1.855270 4.454208 3.592553\n0.136481 0.092910 6.013416\nNa Bi F\n1 1 6\ndirect\n0.500000 0.500000 0.500000 Na\n0.000000 0.000000 0.000000 Bi\n0.395780 0.763228 0.072895 F\n0.072895 0.395781 0.763228 F\n0.763228 0.072895 0.395780 F\n0.604220 0.236773 0.927105 F\n0.927105 0.604220 0.236772 F\n0.236772 0.927105 0.604219 F\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Na",
"Bi",
"F"
],
"chemical_system": "Bi-F-Na",
"density": 4.593954422009585,
"density_atomic": 0.06397362267297932,
"volume": 125.05153945860529,
"volume_molar": 9.413474660930191,
"formula_full": "Na1 Bi1 F6",
"formula_reduced": "NaBiF6",
"formula_anonymous": "ABC6",
"energy_above_hull": 0.0,
"spacegroup": 148
},
{
"id": "jvasp-86086",
"created_at": "2022-09-04T14:35:47.390437Z",
"updated_at": "2022-09-04T14:35:47.390465Z",
"structure_string": "Rb1 In6 Au4\n1.0\n8.270572 -0.000000 -0.000000\n-4.135286 7.162525 -0.000000\n-0.000000 0.000000 4.560261\nRb In Au\n1 6 4\ndirect\n0.000000 0.000000 0.000000 Rb\n0.535262 0.464738 0.000000 In\n0.196816 0.803184 0.500000 In\n0.535262 0.070524 0.000000 In\n0.196816 0.393632 0.500000 In\n0.929476 0.464738 0.000000 In\n0.606368 0.803184 0.500000 In\n0.796064 0.203936 0.500000 Au\n0.333333 0.666667 0.000000 Au\n0.796064 0.592129 0.500000 Au\n0.407871 0.203936 0.500000 Au\n",
"nsites": 11,
"nelements": 3,
"elements": [
"Rb",
"In",
"Au"
],
"chemical_system": "Au-In-Rb",
"density": 9.602980141663949,
"density_atomic": 0.040719392302058975,
"volume": 270.14155610185236,
"volume_molar": 14.789367963370836,
"formula_full": "Rb1 In6 Au4",
"formula_reduced": "Rb(In3Au2)2",
"formula_anonymous": "AB4C6",
"energy_above_hull": 0.0,
"spacegroup": 187
},
{
"id": "jvasp-64144",
"created_at": "2022-09-04T14:35:57.270717Z",
"updated_at": "2022-09-04T14:35:57.270740Z",
"structure_string": "Ba4 Cd1 Hg1\n1.0\n-0.000000 5.075244 5.075244\n5.075244 0.000000 5.075244\n5.075244 5.075244 0.000000\nBa Cd Hg\n4 1 1\ndirect\n0.124623 0.625126 0.625126 Ba\n0.625126 0.625126 0.625126 Ba\n0.625126 0.124623 0.625126 Ba\n0.625126 0.625126 0.124623 Ba\n0.250000 0.250000 0.250000 Cd\n0.000000 0.000000 0.000000 Hg\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Ba",
"Cd",
"Hg"
],
"chemical_system": "Ba-Cd-Hg",
"density": 5.476602765095463,
"density_atomic": 0.022948297709573424,
"volume": 261.4573017979002,
"volume_molar": 26.242211235945934,
"formula_full": "Ba4 Cd1 Hg1",
"formula_reduced": "Ba4CdHg",
"formula_anonymous": "ABC4",
"energy_above_hull": 0.0,
"spacegroup": 216
},
{
"id": "jvasp-94150",
"created_at": "2022-09-04T14:36:01.609020Z",
"updated_at": "2022-09-04T14:36:01.609059Z",
"structure_string": "Mg6 Co1 Sn1\n1.0\n6.184417 0.008767 0.000000\n-3.084616 5.360245 0.000000\n0.000000 0.000000 4.825450\nMg Co Sn\n6 1 1\ndirect\n0.163443 0.819248 0.250000 Mg\n0.680751 0.336557 0.250000 Mg\n0.666688 0.833311 0.250000 Mg\n0.325271 0.643462 0.750000 Mg\n0.856538 0.174729 0.750000 Mg\n0.831384 0.668616 0.750000 Mg\n0.146474 0.353525 0.250000 Co\n0.329450 0.170550 0.750000 Sn\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Mg",
"Co",
"Sn"
],
"chemical_system": "Co-Mg-Sn",
"density": 3.355150680617539,
"density_atomic": 0.049970606502145826,
"volume": 160.09411452023232,
"volume_molar": 12.051366156104987,
"formula_full": "Mg6 Co1 Sn1",
"formula_reduced": "Mg6CoSn",
"formula_anonymous": "ABC6",
"energy_above_hull": 0.0,
"spacegroup": 38
},
{
"id": "jvasp-74804",
"created_at": "2022-09-04T14:35:46.376331Z",
"updated_at": "2022-09-04T14:35:46.376364Z",
"structure_string": "Be1 Zn1 In4\n1.0\n0.000000 4.313014 4.313014\n4.313014 -0.000000 4.313014\n4.313014 4.313014 -0.000000\nBe Zn In\n1 1 4\ndirect\n0.000000 0.000000 0.000000 Be\n0.250000 0.250000 0.250000 Zn\n0.124685 0.625104 0.625104 In\n0.625104 0.625104 0.625104 In\n0.625104 0.124685 0.625104 In\n0.625104 0.625104 0.124685 In\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Be",
"Zn",
"In"
],
"chemical_system": "Be-In-Zn",
"density": 5.522912374971034,
"density_atomic": 0.037391996218586125,
"volume": 160.46214716446806,
"volume_molar": 16.105427281271027,
"formula_full": "Be1 Zn1 In4",
"formula_reduced": "BeZnIn4",
"formula_anonymous": "ABC4",
"energy_above_hull": 0.0,
"spacegroup": 216
},
{
"id": "jvasp-105626",
"created_at": "2022-09-04T14:35:44.357565Z",
"updated_at": "2022-09-04T14:35:44.357591Z",
"structure_string": "Na3 Sb1 I6\n1.0\n7.384719 -0.000000 4.263569\n2.461573 6.962380 4.263569\n-0.000000 0.000000 8.527138\nNa Sb I\n3 1 6\ndirect\n0.750000 0.750000 0.750000 Na\n0.250000 0.250000 0.250000 Na\n0.500000 0.500000 0.500000 Na\n0.000000 0.000000 0.000000 Sb\n0.751589 0.248411 0.248411 I\n0.248411 0.248411 0.751589 I\n0.248411 0.751589 0.751590 I\n0.248411 0.751589 0.248411 I\n0.751589 0.248411 0.751589 I\n0.751589 0.751589 0.248411 I\n",
"nsites": 10,
"nelements": 3,
"elements": [
"Na",
"Sb",
"I"
],
"chemical_system": "I-Na-Sb",
"density": 3.606303516716892,
"density_atomic": 0.022808935187682507,
"volume": 438.4246751422352,
"volume_molar": 26.402551063638132,
"formula_full": "Na3 Sb1 I6",
"formula_reduced": "Na3SbI6",
"formula_anonymous": "AB3C6",
"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-94242",
"created_at": "2022-09-04T14:35:47.654445Z",
"updated_at": "2022-09-04T14:35:47.654467Z",
"structure_string": "Ba1 Mg6 Co1\n1.0\n8.097855 -1.110347 0.000000\n-5.010516 6.457774 0.000000\n0.000000 0.000000 4.460337\nBa Mg Co\n1 6 1\ndirect\n0.275853 0.224147 0.750001 Ba\n0.210094 0.796659 0.250000 Mg\n0.703339 0.289905 0.250000 Mg\n0.681376 0.818622 0.250000 Mg\n0.317569 0.661271 0.750001 Mg\n0.838727 0.182429 0.750001 Mg\n0.870650 0.629347 0.750001 Mg\n0.102384 0.397615 0.250000 Co\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Ba",
"Mg",
"Co"
],
"chemical_system": "Ba-Co-Mg",
"density": 2.7253338357474144,
"density_atomic": 0.038381325679406636,
"volume": 208.43469730104638,
"volume_molar": 15.690288580186166,
"formula_full": "Ba1 Mg6 Co1",
"formula_reduced": "BaMg6Co",
"formula_anonymous": "ABC6",
"energy_above_hull": 0.0,
"spacegroup": 38
},
{
"id": "jvasp-101516",
"created_at": "2022-09-04T14:36:41.586516Z",
"updated_at": "2022-09-04T14:36:41.586541Z",
"structure_string": "Rb2 Ag1 Pd1 F6\n1.0\n5.335493 -0.000000 3.080448\n1.778498 5.030351 3.080448\n-0.000000 -0.000000 6.160897\nRb Ag Pd F\n2 1 1 6\ndirect\n0.250000 0.250000 0.250000 Rb\n0.750000 0.750000 0.750001 Rb\n0.500000 0.500000 0.500001 Ag\n0.000000 0.000000 0.000000 Pd\n0.239117 0.239117 0.760883 F\n0.239118 0.760883 0.760883 F\n0.760883 0.760883 0.239118 F\n0.239118 0.760883 0.239118 F\n0.760882 0.239117 0.760884 F\n0.760882 0.239117 0.239118 F\n",
"nsites": 10,
"nelements": 4,
"elements": [
"Rb",
"Ag",
"Pd",
"F"
],
"chemical_system": "Ag-F-Pd-Rb",
"density": 5.013248726100943,
"density_atomic": 0.060476020799817294,
"volume": 165.35479464003046,
"volume_molar": 9.95789848663157,
"formula_full": "Rb2 Ag1 Pd1 F6",
"formula_reduced": "Rb2AgPdF6",
"formula_anonymous": "ABC2D6",
"energy_above_hull": 0.0,
"spacegroup": 225
}
]
}