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{
"count": 55712,
"next": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=chemical_system&page=4448",
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"results": [
{
"id": "jvasp-79635",
"created_at": "2022-09-04T14:37:17.535105Z",
"updated_at": "2022-09-04T14:37:17.535123Z",
"structure_string": "Rb3 Pt1\n1.0\n5.323143 0.000000 -0.000000\n0.000000 5.323143 0.000000\n0.000000 0.000000 5.323143\nRb Pt\n3 1\ndirect\n0.000000 0.000000 0.500000 Rb\n0.000000 0.500000 0.000000 Rb\n0.500000 0.000000 0.000000 Rb\n0.500000 0.500000 0.500000 Pt\n",
"nsites": 4,
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"elements": [
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],
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"density": 4.970388464469818,
"density_atomic": 0.0265189052675769,
"volume": 150.835789020694,
"volume_molar": 22.708858828207045,
"formula_full": "Rb3 Pt1",
"formula_reduced": "Rb3Pt",
"formula_anonymous": "AB3",
"energy_above_hull": 0.0,
"spacegroup": 221
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{
"id": "jvasp-76200",
"created_at": "2022-09-04T14:36:14.416989Z",
"updated_at": "2022-09-04T14:36:14.417029Z",
"structure_string": "Rb3 Pt1\n1.0\n5.323143 0.000000 -0.000000\n0.000000 5.323143 0.000000\n0.000000 0.000000 5.323143\nRb Pt\n3 1\ndirect\n0.000000 0.000000 0.500000 Rb\n0.000000 0.500000 0.000000 Rb\n0.500000 0.000000 0.000000 Rb\n0.500000 0.500000 0.500000 Pt\n",
"nsites": 4,
"nelements": 2,
"elements": [
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],
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"volume": 150.835789020694,
"volume_molar": 22.708858828207045,
"formula_full": "Rb3 Pt1",
"formula_reduced": "Rb3Pt",
"formula_anonymous": "AB3",
"energy_above_hull": 0.0,
"spacegroup": 221
},
{
"id": "jvasp-2685",
"created_at": "2022-09-04T14:37:00.378639Z",
"updated_at": "2022-09-04T14:37:00.378668Z",
"structure_string": "Rb2 Pt1 S2\n1.0\n3.526533 0.000000 1.044122\n1.256718 5.850218 2.232931\n0.026900 0.017143 6.386654\nRb Pt S\n2 1 2\ndirect\n0.807678 0.692321 0.692321 Rb\n0.192321 0.307679 0.307678 Rb\n0.000000 0.000000 0.000000 Pt\n0.500000 0.788255 0.211745 S\n0.500000 0.211745 0.788254 S\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Rb",
"Pt",
"S"
],
"chemical_system": "Pt-Rb-S",
"density": 5.43236036521805,
"density_atomic": 0.038026815309945096,
"volume": 131.48616204766319,
"volume_molar": 15.836563516863949,
"formula_full": "Rb2 Pt1 S2",
"formula_reduced": "Rb2PtS2",
"formula_anonymous": "AB2C2",
"energy_above_hull": 0.7582482799999998,
"spacegroup": 71
},
{
"id": "jvasp-2325",
"created_at": "2022-09-04T14:37:00.903791Z",
"updated_at": "2022-09-04T14:37:00.903806Z",
"structure_string": "Rb2 Pt3 S4\n1.0\n6.236610 -0.034393 -1.391363\n-3.518953 5.149122 -1.391363\n-0.073504 -0.138336 7.092878\nRb Pt S\n2 3 4\ndirect\n0.348369 0.348368 0.696738 Rb\n0.651632 0.651631 0.303263 Rb\n0.000000 0.500000 0.000000 Pt\n0.500000 0.000000 0.000000 Pt\n0.000000 0.000000 0.000000 Pt\n0.714828 0.049055 0.763883 S\n0.285173 0.950944 0.236118 S\n0.950945 0.285173 0.236118 S\n0.049056 0.714826 0.763883 S\n",
"nsites": 9,
"nelements": 3,
"elements": [
"Rb",
"Pt",
"S"
],
"chemical_system": "Pt-Rb-S",
"density": 6.54168728414855,
"density_atomic": 0.04008769483007571,
"volume": 224.5077956751898,
"volume_molar": 15.022417191925692,
"formula_full": "Rb2 Pt3 S4",
"formula_reduced": "Rb2Pt3S4",
"formula_anonymous": "A2B3C4",
"energy_above_hull": 1.6993582444444444,
"spacegroup": 69
},
{
"id": "jvasp-11363",
"created_at": "2022-09-04T14:37:04.651720Z",
"updated_at": "2022-09-04T14:37:04.651751Z",
"structure_string": "Rb2 Pt4 Se6\n1.0\n6.553829 -0.058135 4.470555\n2.331494 6.125372 4.470555\n-0.085137 -0.058135 7.932924\nRb Pt Se\n2 4 6\ndirect\n0.800052 0.800054 0.800053 Rb\n0.199947 0.199947 0.199947 Rb\n0.000000 0.000000 0.000000 Pt\n0.500000 0.500000 0.000001 Pt\n-0.000001 0.500000 0.500000 Pt\n0.500000 0.000001 0.500000 Pt\n0.765666 0.765667 0.278876 Se\n0.765666 0.278876 0.765667 Se\n0.278874 0.765667 0.765667 Se\n0.234333 0.721125 0.234334 Se\n0.234333 0.234334 0.721125 Se\n0.721125 0.234334 0.234334 Se\n",
"nsites": 12,
"nelements": 3,
"elements": [
"Rb",
"Pt",
"Se"
],
"chemical_system": "Pt-Rb-Se",
"density": 7.326285760470998,
"density_atomic": 0.03715279642594892,
"volume": 322.990492086317,
"volume_molar": 16.209118395712224,
"formula_full": "Rb2 Pt4 Se6",
"formula_reduced": "RbPt2Se3",
"formula_anonymous": "AB2C3",
"energy_above_hull": 1.46151215,
"spacegroup": 166
},
{
"id": "jvasp-2841",
"created_at": "2022-09-04T14:37:01.122743Z",
"updated_at": "2022-09-04T14:37:01.122762Z",
"structure_string": "Rb2 Pt1 Se2\n1.0\n3.666979 0.000000 1.094964\n1.324954 6.065410 2.250543\n0.025105 0.022841 6.603673\nRb Pt Se\n2 1 2\ndirect\n0.197918 0.302082 0.302081 Rb\n0.802080 0.697918 0.697918 Rb\n0.000000 0.000000 0.000000 Pt\n0.499999 0.783095 0.216904 Se\n0.499999 0.216905 0.783095 Se\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Rb",
"Pt",
"Se"
],
"chemical_system": "Pt-Rb-Se",
"density": 5.936488223663909,
"density_atomic": 0.034116878849528645,
"volume": 146.55502404110098,
"volume_molar": 17.651499677213884,
"formula_full": "Rb2 Pt1 Se2",
"formula_reduced": "Rb2PtSe2",
"formula_anonymous": "AB2C2",
"energy_above_hull": 0.5586216266666665,
"spacegroup": 71
},
{
"id": "jvasp-109151",
"created_at": "2022-09-04T14:38:02.011501Z",
"updated_at": "2022-09-04T14:38:02.011527Z",
"structure_string": "Rb1 Si4 Pt4\n1.0\n6.429681 0.002320 -0.831535\n-4.967652 4.082062 -0.831535\n-0.000830 -0.002320 6.483228\nRb Si Pt\n1 4 4\ndirect\n0.477941 0.477941 -0.000001 Rb\n0.359205 0.865028 0.268719 Si\n0.596309 0.090486 0.731280 Si\n0.090486 0.359205 0.494176 Si\n0.865028 0.596309 0.505823 Si\n0.143065 0.658926 0.846476 Pt\n0.812450 0.296588 0.153523 Pt\n0.296589 0.143065 0.484139 Pt\n0.658926 0.812449 0.515860 Pt\n",
"nsites": 9,
"nelements": 3,
"elements": [
"Rb",
"Si",
"Pt"
],
"chemical_system": "Pt-Rb-Si",
"density": 9.542562090015792,
"density_atomic": 0.052875539539480446,
"volume": 170.21102911451132,
"volume_molar": 11.389275291467168,
"formula_full": "Rb1 Si4 Pt4",
"formula_reduced": "Rb(SiPt)4",
"formula_anonymous": "AB4C4",
"energy_above_hull": 2.834235555555555,
"spacegroup": 87
},
{
"id": "jvasp-92725",
"created_at": "2022-09-04T14:36:32.001476Z",
"updated_at": "2022-09-04T14:36:32.001487Z",
"structure_string": "Rb2 Te2 Pt1\n1.0\n0.000000 0.000000 4.039238\n-5.348256 4.037567 2.019619\n-5.348256 -4.037567 2.019619\nRb Te Pt\n2 2 1\ndirect\n0.203898 0.296102 0.296102 Rb\n0.796102 0.703898 0.703898 Rb\n0.500000 0.218897 0.781103 Te\n0.500000 0.781103 0.218897 Te\n0.000000 0.000000 0.000000 Pt\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Rb",
"Te",
"Pt"
],
"chemical_system": "Pt-Rb-Te",
"density": 5.913340386704147,
"density_atomic": 0.028662141521960675,
"volume": 174.44614165236206,
"volume_molar": 21.01078440138847,
"formula_full": "Rb2 Te2 Pt1",
"formula_reduced": "Rb2Te2Pt",
"formula_anonymous": "AB2C2",
"energy_above_hull": 0.3772013866666666,
"spacegroup": 71
},
{
"id": "jvasp-41916",
"created_at": "2022-09-04T14:37:33.291921Z",
"updated_at": "2022-09-04T14:37:33.291939Z",
"structure_string": "Re6 Pt2\n1.0\n2.800123 -4.849955 -0.000000\n2.800123 4.849955 -0.000000\n-0.000000 -0.000000 4.442904\nRe Pt\n6 2\ndirect\n0.840682 0.159317 0.250000 Re\n0.840682 0.681365 0.250000 Re\n0.318634 0.159317 0.250000 Re\n0.159317 0.840682 0.749999 Re\n0.159317 0.318634 0.749999 Re\n0.681365 0.840682 0.749999 Re\n0.666666 0.333333 0.749999 Pt\n0.333333 0.666666 0.250000 Pt\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Re",
"Pt"
],
"chemical_system": "Pt-Re",
"density": 20.742865273176623,
"density_atomic": 0.06629461366659578,
"volume": 120.67345380777145,
"volume_molar": 9.08390656032197,
"formula_full": "Re6 Pt2",
"formula_reduced": "Re3Pt",
"formula_anonymous": "AB3",
"energy_above_hull": 5.795351349999999,
"spacegroup": 194
},
{
"id": "jvasp-79289",
"created_at": "2022-09-04T14:36:39.472976Z",
"updated_at": "2022-09-04T14:36:39.473002Z",
"structure_string": "Re2 Pt1 Rh1\n1.0\n0.000000 3.126084 3.126084\n3.126084 0.000000 3.126084\n3.126084 3.126084 0.000000\nRe Pt Rh\n2 1 1\ndirect\n0.250000 0.250000 0.250000 Re\n0.749999 0.749999 0.749999 Re\n0.000000 0.000000 0.000000 Pt\n0.499999 0.499999 0.499999 Rh\n",
"nsites": 4,
"nelements": 3,
"elements": [
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"Pt",
"Rh"
],
"chemical_system": "Pt-Re-Rh",
"density": 18.220212755741883,
"density_atomic": 0.0654678479036244,
"volume": 61.098693909847526,
"volume_molar": 9.198623374431413,
"formula_full": "Re2 Pt1 Rh1",
"formula_reduced": "Re2PtRh",
"formula_anonymous": "ABC2",
"energy_above_hull": 4.9758951,
"spacegroup": 225
},
{
"id": "jvasp-39805",
"created_at": "2022-09-04T14:37:45.750964Z",
"updated_at": "2022-09-04T14:37:45.750981Z",
"structure_string": "Ti2 Re1 Pt1\n1.0\n-0.000000 3.132952 3.132952\n3.132952 0.000000 3.132952\n3.132952 3.132952 0.000000\nTi Re Pt\n2 1 1\ndirect\n0.000000 0.000000 0.000000 Ti\n0.500000 0.500000 0.500000 Ti\n0.750000 0.750000 0.750000 Re\n0.250000 0.250000 0.250000 Pt\n",
"nsites": 4,
"nelements": 3,
"elements": [
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"Re",
"Pt"
],
"chemical_system": "Pt-Re-Ti",
"density": 12.879500452788267,
"density_atomic": 0.06503823881094577,
"volume": 61.50228039887836,
"volume_molar": 9.259384740575861,
"formula_full": "Ti2 Re1 Pt1",
"formula_reduced": "Ti2RePt",
"formula_anonymous": "ABC2",
"energy_above_hull": 4.1257640166666665,
"spacegroup": 225
},
{
"id": "jvasp-110533",
"created_at": "2022-09-04T14:38:38.749346Z",
"updated_at": "2022-09-04T14:38:38.749362Z",
"structure_string": "Ti2 Re1 Pt1\n1.0\n3.175694 0.000000 -0.000000\n0.000000 3.175694 0.000000\n0.000000 0.000000 6.128746\nTi Re Pt\n2 1 1\ndirect\n0.499999 0.499999 0.258909 Ti\n0.499999 0.499999 0.741091 Ti\n0.000000 0.000000 0.500000 Re\n0.000000 0.000000 0.000000 Pt\n",
"nsites": 4,
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"elements": [
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],
"chemical_system": "Pt-Re-Ti",
"density": 12.815670057154788,
"density_atomic": 0.0647159113627792,
"volume": 61.8086018688221,
"volume_molar": 9.305502515821145,
"formula_full": "Ti2 Re1 Pt1",
"formula_reduced": "Ti2RePt",
"formula_anonymous": "ABC2",
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"spacegroup": 123
}
]
}