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=-chemical_system&page=1534",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-chemical_system&page=1532",
"results": [
{
"id": "jvasp-17699",
"created_at": "2022-09-04T14:37:34.704123Z",
"updated_at": "2022-09-04T14:37:34.704138Z",
"structure_string": "In2 Ga2 Te4\n1.0\n6.692694 -0.036702 -1.715682\n-4.037317 5.337938 -1.715682\n0.018384 0.036702 6.909080\nIn Ga Te\n2 2 4\ndirect\n0.749999 0.750001 0.000001 In\n0.250000 0.250000 0.000000 In\n0.249999 0.750000 0.500000 Ga\n0.749999 0.250000 0.500000 Ga\n0.672560 0.172561 0.845123 Te\n0.172561 0.327439 0.500000 Te\n0.827438 0.672562 0.500000 Te\n0.327438 0.827439 0.154878 Te\n",
"nsites": 8,
"nelements": 3,
"elements": [
"In",
"Ga",
"Te"
],
"chemical_system": "Ga-In-Te",
"density": 5.9210084749008285,
"density_atomic": 0.032434679949632235,
"volume": 246.64957423422055,
"volume_molar": 18.566980680406818,
"formula_full": "In2 Ga2 Te4",
"formula_reduced": "InGaTe2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.1447719570833334,
"spacegroup": 140
},
{
"id": "jvasp-111044",
"created_at": "2022-09-04T14:38:36.421840Z",
"updated_at": "2022-09-04T14:38:36.421861Z",
"structure_string": "In3 Ga1 Te4\n1.0\n6.753546 0.050272 -1.764459\n-4.018011 5.428489 -1.764459\n-0.025101 -0.050272 6.980191\nIn Ga Te\n3 1 4\ndirect\n0.500000 -0.000000 0.500000 In\n0.000000 0.500000 0.500000 In\n0.500000 0.500000 -0.000000 In\n0.000000 0.000000 0.000000 Ga\n0.411235 0.411235 0.356361 Te\n0.054874 0.054874 0.643639 Te\n0.588766 0.945126 -0.000000 Te\n0.945127 0.588765 -0.000000 Te\n",
"nsites": 8,
"nelements": 3,
"elements": [
"In",
"Ga",
"Te"
],
"chemical_system": "Ga-In-Te",
"density": 5.994419753871294,
"density_atomic": 0.031235247725013814,
"volume": 256.12090771392985,
"volume_molar": 19.27995197290319,
"formula_full": "In3 Ga1 Te4",
"formula_reduced": "In3GaTe4",
"formula_anonymous": "AB3C4",
"energy_above_hull": 0.2131129127083334,
"spacegroup": 121
},
{
"id": "jvasp-105362",
"created_at": "2022-09-04T14:36:47.437325Z",
"updated_at": "2022-09-04T14:36:47.437346Z",
"structure_string": "Tl1 In2 Ga1 Se4\n1.0\n6.427583 -0.037422 -1.694442\n-2.571182 5.170259 -3.292993\n-0.022323 0.037422 6.647139\nTl In Ga Se\n1 2 1 4\ndirect\n0.000000 0.000000 0.000000 Tl\n0.500000 -0.000000 0.500000 In\n0.000000 0.500000 0.500000 In\n0.500000 0.500000 0.000000 Ga\n0.501322 0.101429 0.938686 Se\n0.498678 0.437364 0.600108 Se\n0.162743 0.562636 0.061315 Se\n0.837257 0.898571 0.399894 Se\n",
"nsites": 8,
"nelements": 4,
"elements": [
"Tl",
"In",
"Ga",
"Se"
],
"chemical_system": "Ga-In-Se-Tl",
"density": 6.157671665230166,
"density_atomic": 0.036196355665264635,
"volume": 221.0167253847905,
"volume_molar": 16.63742288226842,
"formula_full": "Tl1 In2 Ga1 Se4",
"formula_reduced": "TlIn2GaSe4",
"formula_anonymous": "ABC2D4",
"energy_above_hull": 0.4423447914583333,
"spacegroup": 23
},
{
"id": "jvasp-104733",
"created_at": "2022-09-04T14:36:51.300051Z",
"updated_at": "2022-09-04T14:36:51.300065Z",
"structure_string": "In2 Ga2 Se4\n1.0\n6.451050 -0.029217 -1.487519\n-4.089047 4.989649 -1.487519\n0.013912 0.029217 6.620315\nIn Ga Se\n2 2 4\ndirect\n0.573145 0.573145 -0.000000 In\n0.073145 0.073145 -0.000000 In\n0.258351 0.758352 0.499999 Ga\n0.758351 0.258352 0.499999 Ga\n0.170995 0.346508 0.500000 Se\n0.846507 0.670995 0.499999 Se\n0.346507 0.846508 0.175512 Se\n0.670995 0.170996 0.824487 Se\n",
"nsites": 8,
"nelements": 3,
"elements": [
"In",
"Ga",
"Se"
],
"chemical_system": "Ga-In-Se",
"density": 5.342912667777414,
"density_atomic": 0.03758182352426929,
"volume": 212.86886185375823,
"volume_molar": 16.02407811880408,
"formula_full": "In2 Ga2 Se4",
"formula_reduced": "InGaSe2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.3255697570833333,
"spacegroup": 108
},
{
"id": "jvasp-90610",
"created_at": "2022-09-04T14:35:54.078653Z",
"updated_at": "2022-09-04T14:35:54.078685Z",
"structure_string": "In2 Ga2 Se4\n1.0\n0.000000 -0.000000 -6.420972\n-4.040527 4.040527 -3.210487\n4.040527 4.040527 -3.210487\nIn Ga Se\n2 2 4\ndirect\n0.750000 0.000000 0.000000 In\n0.250000 0.000000 0.000000 In\n0.250000 0.500000 0.500000 Ga\n0.750000 0.500000 0.500000 Ga\n0.336564 0.500000 0.826872 Se\n0.663436 0.500000 0.173129 Se\n0.836564 0.826872 0.500000 Se\n0.163436 0.173129 0.500000 Se\n",
"nsites": 8,
"nelements": 3,
"elements": [
"In",
"Ga",
"Se"
],
"chemical_system": "Ga-In-Se",
"density": 5.424796054296916,
"density_atomic": 0.038157787829339165,
"volume": 209.6557598092433,
"volume_molar": 15.782206208950173,
"formula_full": "In2 Ga2 Se4",
"formula_reduced": "InGaSe2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.3321297570833333,
"spacegroup": 140
},
{
"id": "jvasp-109173",
"created_at": "2022-09-04T14:38:27.337976Z",
"updated_at": "2022-09-04T14:38:27.338006Z",
"structure_string": "In1 Ga1 Sb2\n1.0\n4.352444 0.008378 6.563574\n1.984704 3.873602 6.563574\n0.013677 0.008378 7.875538\nIn Ga Sb\n1 1 2\ndirect\n0.500702 0.500703 0.500702 In\n0.999842 0.999844 0.999844 Ga\n0.120398 0.120398 0.120398 Sb\n0.629055 0.629056 0.629056 Sb\n",
"nsites": 4,
"nelements": 3,
"elements": [
"In",
"Ga",
"Sb"
],
"chemical_system": "Ga-In-Sb",
"density": 5.377990206452471,
"density_atomic": 0.030263924104602376,
"volume": 132.1705667174767,
"volume_molar": 19.898743927540394,
"formula_full": "In1 Ga1 Sb2",
"formula_reduced": "InGaSb2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.5440261237500001,
"spacegroup": 160
},
{
"id": "jvasp-108770",
"created_at": "2022-09-04T14:38:01.859413Z",
"updated_at": "2022-09-04T14:38:01.859445Z",
"structure_string": "In1 Ga1 Sb2\n1.0\n4.525823 -0.000000 0.000000\n0.000000 4.525823 0.000000\n-0.000000 -0.000000 6.438745\nIn Ga Sb\n1 1 2\ndirect\n0.500000 0.500000 0.500000 In\n0.000000 0.000000 0.000000 Ga\n-0.000000 0.500000 0.233244 Sb\n0.500000 0.000000 0.766756 Sb\n",
"nsites": 4,
"nelements": 3,
"elements": [
"In",
"Ga",
"Sb"
],
"chemical_system": "Ga-In-Sb",
"density": 5.389623192636535,
"density_atomic": 0.03032938718606393,
"volume": 131.88528919034547,
"volume_molar": 19.85579439193917,
"formula_full": "In1 Ga1 Sb2",
"formula_reduced": "InGaSb2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.5426261237500001,
"spacegroup": 115
},
{
"id": "jvasp-119180",
"created_at": "2022-09-04T14:38:51.584816Z",
"updated_at": "2022-09-04T14:38:51.584838Z",
"structure_string": "In5 Ga5 S15\n1.0\n6.665352 0.001668 0.508406\n3.272617 5.742870 0.948584\n-0.074272 -0.065567 15.302621\nIn Ga S\n5 5 15\ndirect\n0.655458 0.668912 0.003536 In\n0.340407 0.322315 0.012530 In\n0.993713 0.016505 0.003824 In\n0.003204 0.416572 0.740469 In\n0.665893 0.082666 0.740056 In\n0.332463 0.925645 0.317080 Ga\n0.014582 0.574523 0.253892 Ga\n-0.024858 0.841414 0.447804 Ga\n0.687740 0.484311 0.447788 Ga\n0.331228 0.749035 0.753945 Ga\n0.671172 0.571627 0.289641 S\n0.324214 0.700790 0.901688 S\n0.666885 0.030853 0.903383 S\n0.003224 0.373379 0.903353 S\n0.030242 0.769736 0.678035 S\n0.333682 0.074381 0.676589 S\n0.331370 0.827859 0.471579 S\n0.329157 0.968240 0.092636 S\n0.666126 0.311390 0.092533 S\n0.993024 0.647448 0.091571 S\n0.356527 0.249927 0.278092 S\n0.671549 0.158854 0.499758 S\n0.993685 0.497085 0.497649 S\n0.638665 0.465062 0.680628 S\n-0.009179 0.915336 0.289838 S\n",
"nsites": 25,
"nelements": 3,
"elements": [
"In",
"Ga",
"S"
],
"chemical_system": "Ga-In-S",
"density": 3.976254699223959,
"density_atomic": 0.04264783551915896,
"volume": 586.1962206445176,
"volume_molar": 14.12062461480521,
"formula_full": "In5 Ga5 S15",
"formula_reduced": "InGaS3",
"formula_anonymous": "ABC3",
"energy_above_hull": 0.883934459,
"spacegroup": 1
},
{
"id": "jvasp-12274",
"created_at": "2022-09-04T14:36:43.530737Z",
"updated_at": "2022-09-04T14:36:43.530764Z",
"structure_string": "In2 Ga2 S6\n1.0\n3.730781 0.000000 -0.745961\n0.000000 6.220325 0.000000\n0.026595 0.000000 9.835389\nIn Ga S\n2 2 6\ndirect\n0.333921 0.503339 0.667841 In\n0.666080 0.003338 0.332159 In\n0.886270 0.056407 0.772538 Ga\n0.113731 0.556407 0.227462 Ga\n0.898763 0.695705 0.797525 S\n0.101238 0.195704 0.202475 S\n0.563525 0.708177 0.127050 S\n0.436476 0.208177 0.872950 S\n0.780003 0.242274 0.560004 S\n0.219998 0.742274 0.439996 S\n",
"nsites": 10,
"nelements": 3,
"elements": [
"In",
"Ga",
"S"
],
"chemical_system": "Ga-In-S",
"density": 4.082611778793598,
"density_atomic": 0.04378858217119543,
"volume": 228.3700340171804,
"volume_molar": 13.752764902174487,
"formula_full": "In2 Ga2 S6",
"formula_reduced": "InGaS3",
"formula_anonymous": "ABC3",
"energy_above_hull": 0.877734459,
"spacegroup": 36
},
{
"id": "jvasp-103089",
"created_at": "2022-09-04T14:36:44.857679Z",
"updated_at": "2022-09-04T14:36:44.857693Z",
"structure_string": "In2 Ga1 S4\n1.0\n3.954266 0.000000 -0.000000\n-1.977133 3.424493 0.000000\n-0.000000 0.000000 12.732479\nIn Ga S\n2 1 4\ndirect\n0.666668 0.333333 0.007901 In\n0.000000 -0.000000 0.694239 In\n0.333334 0.666666 0.306177 Ga\n0.000000 -0.000000 0.889576 S\n0.333334 0.666666 0.124461 S\n0.000000 -0.000000 0.369545 S\n0.333334 0.666666 0.608101 S\n",
"nsites": 7,
"nelements": 3,
"elements": [
"In",
"Ga",
"S"
],
"chemical_system": "Ga-In-S",
"density": 4.118423080473833,
"density_atomic": 0.040599707814414285,
"volume": 172.4150339208786,
"volume_molar": 14.832965763024367,
"formula_full": "In2 Ga1 S4",
"formula_reduced": "In2GaS4",
"formula_anonymous": "AB2C4",
"energy_above_hull": 0.9250303235714286,
"spacegroup": 156
},
{
"id": "jvasp-101184",
"created_at": "2022-09-04T14:36:41.858735Z",
"updated_at": "2022-09-04T14:36:41.858747Z",
"structure_string": "In1 Ga1 P2\n1.0\n3.882136 0.002991 5.874736\n1.767939 3.456209 5.874736\n0.004885 0.002991 7.041553\nIn Ga P\n1 1 2\ndirect\n0.500603 0.500601 0.500601 In\n0.000191 0.000191 0.000191 Ga\n0.119384 0.119384 0.119384 P\n0.629825 0.629823 0.629822 P\n",
"nsites": 4,
"nelements": 3,
"elements": [
"In",
"Ga",
"P"
],
"chemical_system": "Ga-In-P",
"density": 4.340150573368817,
"density_atomic": 0.04241495264331919,
"volume": 94.30636487177696,
"volume_molar": 14.198155095544006,
"formula_full": "In1 Ga1 P2",
"formula_reduced": "InGaP2",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.18020832375,
"spacegroup": 160
},
{
"id": "jvasp-100631",
"created_at": "2022-09-04T14:36:39.051869Z",
"updated_at": "2022-09-04T14:36:39.051881Z",
"structure_string": "Zn1 In1 Ga1 O4\n1.0\n3.290529 0.003233 8.283759\n1.587662 2.882173 8.283759\n0.005466 0.003233 8.913373\nZn In Ga O\n1 1 1 4\ndirect\n0.219054 0.219053 0.219054 Zn\n0.003131 0.003131 0.003131 In\n0.787006 0.787001 0.787004 Ga\n0.295275 0.295273 0.295274 O\n0.711239 0.711235 0.711238 O\n0.120831 0.120830 0.120831 O\n0.863473 0.863468 0.863471 O\n",
"nsites": 7,
"nelements": 4,
"elements": [
"Zn",
"In",
"Ga",
"O"
],
"chemical_system": "Ga-In-O-Zn",
"density": 6.18328082640887,
"density_atomic": 0.08302535600105897,
"volume": 84.31159271284204,
"volume_molar": 7.253375414521786,
"formula_full": "Zn1 In1 Ga1 O4",
"formula_reduced": "ZnInGaO4",
"formula_anonymous": "ABCD4",
"energy_above_hull": 0.9064052421428574,
"spacegroup": 160
}
]
}