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=volume_molar&page=3882",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=volume_molar&page=3880",
"results": [
{
"id": "jvasp-113742",
"created_at": "2022-09-04T14:38:48.472485Z",
"updated_at": "2022-09-04T14:38:48.472518Z",
"structure_string": "Ca1 Sb1 Au1\n1.0\n5.343674 -0.000000 -0.000000\n-2.671837 4.627757 0.000000\n0.000000 -0.000000 3.325205\nCa Sb Au\n1 1 1\ndirect\n0.333333 0.666667 -0.000000 Ca\n0.666666 0.333333 0.000000 Sb\n0.000000 0.000000 0.000000 Au\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Ca",
"Sb",
"Au"
],
"chemical_system": "Au-Ca-Sb",
"density": 7.245663076944564,
"density_atomic": 0.03648314993779301,
"volume": 82.22974181547549,
"volume_molar": 16.50663599570838,
"formula_full": "Ca1 Sb1 Au1",
"formula_reduced": "CaSbAu",
"formula_anonymous": "ABC",
"energy_above_hull": 0.3764746966666669,
"spacegroup": 187
},
{
"id": "jvasp-115655",
"created_at": "2022-09-04T14:38:50.089214Z",
"updated_at": "2022-09-04T14:38:50.089237Z",
"structure_string": "Be1 Sb1 Te1\n1.0\n4.086120 1.188168 0.000000\n0.761635 6.588152 0.000000\n0.000000 0.000000 3.160917\nBe Sb Te\n1 1 1\ndirect\n0.373559 0.059856 0.000000 Be\n-0.020210 -0.138896 0.000000 Sb\n-0.081321 0.402497 0.000000 Te\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Be",
"Sb",
"Te"
],
"chemical_system": "Be-Sb-Te",
"density": 5.217439701308397,
"density_atomic": 0.03648243714443259,
"volume": 82.23134841905198,
"volume_molar": 16.506958502137817,
"formula_full": "Be1 Sb1 Te1",
"formula_reduced": "BeSbTe",
"formula_anonymous": "ABC",
"energy_above_hull": 1.3512833222222225,
"spacegroup": 6
},
{
"id": "jvasp-17808",
"created_at": "2022-09-04T14:38:13.636422Z",
"updated_at": "2022-09-04T14:38:13.636443Z",
"structure_string": "La1 In3\n1.0\n4.786271 -0.000000 -0.000000\n0.000000 4.786271 -0.000000\n0.000000 0.000000 4.786271\nLa In\n1 3\ndirect\n0.000000 0.000000 0.000000 La\n0.500000 0.000000 0.500000 In\n0.000000 0.500000 0.500000 In\n0.500000 0.500000 0.000000 In\n",
"nsites": 4,
"nelements": 2,
"elements": [
"La",
"In"
],
"chemical_system": "In-La",
"density": 7.320276317912597,
"density_atomic": 0.03648111779318077,
"volume": 109.6457631226338,
"volume_molar": 16.50755548155295,
"formula_full": "La1 In3",
"formula_reduced": "LaIn3",
"formula_anonymous": "AB3",
"energy_above_hull": 0.0,
"spacegroup": 221
},
{
"id": "jvasp-8214",
"created_at": "2022-09-04T14:38:08.860812Z",
"updated_at": "2022-09-04T14:38:08.860822Z",
"structure_string": "Tl3 As1 S3\n1.0\n5.840464 -0.000030 -1.660415\n-2.198252 5.410981 -1.660415\n-0.000020 -0.000030 6.071903\nTl As S\n3 1 3\ndirect\n0.612109 0.000311 0.000311 Tl\n0.000311 0.000311 0.612109 Tl\n0.000312 0.612109 0.000311 Tl\n0.446945 0.446945 0.446944 As\n0.059733 0.427794 0.427794 S\n0.427794 0.427794 0.059732 S\n0.427794 0.059733 0.427794 S\n",
"nsites": 7,
"nelements": 3,
"elements": [
"Tl",
"As",
"S"
],
"chemical_system": "As-S-Tl",
"density": 6.786827265432547,
"density_atomic": 0.03647976852798817,
"volume": 191.8871824701801,
"volume_molar": 16.508166041074702,
"formula_full": "Tl3 As1 S3",
"formula_reduced": "Tl3AsS3",
"formula_anonymous": "AB3C3",
"energy_above_hull": 0.937722792857143,
"spacegroup": 160
},
{
"id": "jvasp-68868",
"created_at": "2022-09-04T14:36:13.168386Z",
"updated_at": "2022-09-04T14:36:13.168413Z",
"structure_string": "Be1 Tl2 Te1\n1.0\n3.679021 0.000000 0.000000\n0.000000 3.679021 0.000000\n-0.000000 0.000000 8.101237\nBe Tl Te\n1 2 1\ndirect\n0.000000 0.000000 0.655598 Be\n0.000000 0.000000 0.980614 Tl\n0.500000 0.500000 0.236655 Tl\n0.500000 0.500000 0.627133 Te\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Be",
"Tl",
"Te"
],
"chemical_system": "Be-Te-Tl",
"density": 8.259076027837041,
"density_atomic": 0.03647910043142419,
"volume": 109.6518267362284,
"volume_molar": 16.50846837991747,
"formula_full": "Be1 Tl2 Te1",
"formula_reduced": "BeTl2Te",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.4086747666666667,
"spacegroup": 99
},
{
"id": "jvasp-106445",
"created_at": "2022-09-04T14:36:56.728348Z",
"updated_at": "2022-09-04T14:36:56.728381Z",
"structure_string": "Rb2 Ta1 Ag1 Cl6\n1.0\n6.314741 -0.000000 3.645818\n2.104914 5.953595 3.645818\n-0.000000 -0.000000 7.291635\nRb Ta Ag Cl\n2 1 1 6\ndirect\n0.749999 0.750001 0.750001 Rb\n0.250000 0.250000 0.250000 Rb\n0.499999 0.500000 0.500001 Ta\n0.000000 0.000000 0.000000 Ag\n0.740143 0.259857 0.259858 Cl\n0.259857 0.259857 0.740144 Cl\n0.259856 0.740144 0.740144 Cl\n0.259856 0.740144 0.259858 Cl\n0.740143 0.259857 0.740144 Cl\n0.740142 0.740144 0.259858 Cl\n",
"nsites": 10,
"nelements": 4,
"elements": [
"Rb",
"Ta",
"Ag",
"Cl"
],
"chemical_system": "Ag-Cl-Rb-Ta",
"density": 4.073446848360743,
"density_atomic": 0.03647877523293558,
"volume": 274.1320106320703,
"volume_molar": 16.50861554848144,
"formula_full": "Rb2 Ta1 Ag1 Cl6",
"formula_reduced": "Rb2TaAgCl6",
"formula_anonymous": "ABC2D6",
"energy_above_hull": 0.4825600865000006,
"spacegroup": 225
},
{
"id": "jvasp-87107",
"created_at": "2022-09-04T14:38:17.812085Z",
"updated_at": "2022-09-04T14:38:17.812103Z",
"structure_string": "Rb4 Co2 S4\n1.0\n5.572685 0.000000 -2.336900\n-1.259617 6.129590 -3.003745\n0.075452 0.002114 7.992827\nRb Co S\n4 2 4\ndirect\n0.647946 0.809586 0.295893 Rb\n0.352054 0.190413 0.704108 Rb\n0.852054 0.513693 0.704108 Rb\n0.147946 0.486306 0.295893 Rb\n0.250000 -0.000000 0.000000 Co\n0.750001 -0.000000 0.000000 Co\n0.403588 0.727984 0.807178 S\n0.596412 0.272015 0.192823 S\n0.096411 0.920807 0.192823 S\n0.903588 0.079192 0.807178 S\n",
"nsites": 10,
"nelements": 3,
"elements": [
"Rb",
"Co",
"S"
],
"chemical_system": "Co-Rb-S",
"density": 3.5616116792504093,
"density_atomic": 0.03647723602458658,
"volume": 274.1435780183495,
"volume_molar": 16.50931215276543,
"formula_full": "Rb4 Co2 S4",
"formula_reduced": "Rb2CoS2",
"formula_anonymous": "AB2C2",
"energy_above_hull": 0.9344081799999998,
"spacegroup": 72
},
{
"id": "jvasp-80456",
"created_at": "2022-09-04T14:37:17.336717Z",
"updated_at": "2022-09-04T14:37:17.336729Z",
"structure_string": "Y2 Cd1 Ir1\n1.0\n-13.272567 0.000000 -7.662918\n-7.939078 -0.701241 -1.574953\n-6.739981 2.690321 -3.651852\nY Cd Ir\n2 1 1\ndirect\n0.669533 0.000000 -0.000000 Y\n0.330467 0.000000 -0.000000 Y\n0.000000 0.000000 0.000000 Cd\n0.500000 0.000000 -0.000000 Ir\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Y",
"Cd",
"Ir"
],
"chemical_system": "Cd-Ir-Y",
"density": 7.305330427044976,
"density_atomic": 0.036476043033091224,
"volume": 109.66101768141854,
"volume_molar": 16.50985210905878,
"formula_full": "Y2 Cd1 Ir1",
"formula_reduced": "Y2CdIr",
"formula_anonymous": "ABC2",
"energy_above_hull": 2.1299254375,
"spacegroup": 71
},
{
"id": "jvasp-112272",
"created_at": "2022-09-04T14:38:26.231063Z",
"updated_at": "2022-09-04T14:38:26.231091Z",
"structure_string": "Tl2 Sb2 P4 Se12\n1.0\n7.807242 -0.000000 0.000000\n0.000000 6.957693 0.102866\n-0.000000 -0.036020 10.093638\nTl Sb P Se\n2 2 4 12\ndirect\n0.777840 0.190383 0.000778 Tl\n0.277840 0.809616 -0.000778 Tl\n0.512772 0.309113 0.516895 Sb\n0.012772 0.690887 0.483106 Sb\n0.288343 0.302333 0.808417 P\n0.788343 0.697666 0.191583 P\n0.069773 0.194800 0.678482 P\n0.569773 0.805200 0.321518 P\n0.876702 0.432216 0.305605 Se\n0.376702 0.567783 0.694396 Se\n0.195737 0.340202 0.008055 Se\n0.695737 0.659798 0.991946 Se\n0.990610 0.916126 0.227516 Se\n0.972059 0.923747 0.765110 Se\n0.695187 0.851580 0.523556 Se\n0.195187 0.148420 0.476444 Se\n0.872304 0.429732 0.678514 Se\n0.472060 0.076253 0.234890 Se\n0.490610 0.083873 0.772485 Se\n0.372304 0.570268 0.321486 Se\n",
"nsites": 20,
"nelements": 4,
"elements": [
"Tl",
"Sb",
"P",
"Se"
],
"chemical_system": "P-Sb-Se-Tl",
"density": 5.220085941889919,
"density_atomic": 0.03647509691563736,
"volume": 548.3193107411795,
"volume_molar": 16.510280353547813,
"formula_full": "Tl2 Sb2 P4 Se12",
"formula_reduced": "TlSb(PSe3)2",
"formula_anonymous": "ABC2D6",
"energy_above_hull": 1.80847999,
"spacegroup": 4
},
{
"id": "jvasp-23358",
"created_at": "2022-09-04T14:37:32.669016Z",
"updated_at": "2022-09-04T14:37:32.669031Z",
"structure_string": "Pa6 Sb8\n1.0\n7.476120 0.000000 -2.643207\n-3.738060 6.474510 -2.643207\n-0.000000 -0.000000 7.929623\nPa Sb\n6 8\ndirect\n0.750000 0.875000 0.124999 Pa\n0.625000 0.375000 0.250000 Pa\n0.875000 0.125000 0.749999 Pa\n0.125000 0.750000 0.874999 Pa\n0.375000 0.250000 0.625000 Pa\n0.250000 0.625000 0.375000 Pa\n0.658219 0.658218 0.658218 Sb\n0.341781 0.500000 -0.000000 Sb\n0.500000 -0.000000 0.341781 Sb\n0.000000 0.341781 0.500000 Sb\n0.500000 0.000000 0.841781 Sb\n0.000000 0.841781 0.500000 Sb\n0.158219 0.158219 0.158218 Sb\n0.841781 0.500000 -0.000000 Sb\n",
"nsites": 14,
"nelements": 2,
"elements": [
"Pa",
"Sb"
],
"chemical_system": "Pa-Sb",
"density": 10.211269200462837,
"density_atomic": 0.03647475017556578,
"volume": 383.82716626195065,
"volume_molar": 16.510437305295643,
"formula_full": "Pa6 Sb8",
"formula_reduced": "Pa3Sb4",
"formula_anonymous": "A3B4",
"energy_above_hull": 3.3133991,
"spacegroup": 220
},
{
"id": "jvasp-8490",
"created_at": "2022-09-04T14:37:05.867884Z",
"updated_at": "2022-09-04T14:37:05.867918Z",
"structure_string": "In4 Se4\n1.0\n0.000000 11.901998 -0.204208\n4.169449 0.000000 0.000000\n0.000000 -1.714352 -4.390364\nIn Se\n4 4\ndirect\n0.886218 0.000000 0.031792 In\n0.113782 0.000000 0.968207 In\n0.386218 0.500000 0.031792 In\n0.613782 0.500000 0.968208 In\n0.156205 0.500000 0.645734 Se\n0.843795 0.500000 0.354265 Se\n0.656205 0.000000 0.645734 Se\n0.343795 0.000000 0.354265 Se\n",
"nsites": 8,
"nelements": 2,
"elements": [
"In",
"Se"
],
"chemical_system": "In-Se",
"density": 5.868330585002781,
"density_atomic": 0.03647463883548453,
"volume": 219.33047880427978,
"volume_molar": 16.510487703969616,
"formula_full": "In4 Se4",
"formula_reduced": "InSe",
"formula_anonymous": "AB",
"energy_above_hull": 0.0939444555555555,
"spacegroup": 12
},
{
"id": "jvasp-102568",
"created_at": "2022-09-04T14:36:49.990193Z",
"updated_at": "2022-09-04T14:36:49.990228Z",
"structure_string": "Tb1 Pa1\n1.0\n3.308412 0.000000 0.000000\n-1.654206 2.865169 0.000000\n0.000000 0.000000 5.784702\nTb Pa\n1 1\ndirect\n0.000000 0.000000 0.000000 Tb\n0.333332 0.666667 0.500000 Pa\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Tb",
"Pa"
],
"chemical_system": "Pa-Tb",
"density": 11.809179036631699,
"density_atomic": 0.03647364556892676,
"volume": 54.8341129273865,
"volume_molar": 16.51093732492286,
"formula_full": "Tb1 Pa1",
"formula_reduced": "TbPa",
"formula_anonymous": "AB",
"energy_above_hull": 2.11936575,
"spacegroup": 187
}
]
}