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{
"count": 55712,
"next": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-chemical_system&page=1546",
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"results": [
{
"id": "jvasp-108937",
"created_at": "2022-09-04T14:38:09.456674Z",
"updated_at": "2022-09-04T14:38:09.456701Z",
"structure_string": "Ho3 Mn3 Ga2 Ge1\n1.0\n6.889747 0.000000 0.000000\n-3.444874 5.966696 0.000000\n-0.000000 -0.000000 4.113148\nHo Mn Ga Ge\n3 3 2 1\ndirect\n0.420755 0.419323 0.500000 Ho\n0.580677 0.001431 0.500000 Ho\n0.998569 0.579246 0.500000 Ho\n0.777927 0.773428 -0.000000 Mn\n0.226572 0.004498 -0.000000 Mn\n0.995502 0.222074 -0.000000 Mn\n0.333334 0.666667 -0.000000 Ga\n0.000000 0.000000 0.500000 Ga\n0.666667 0.333334 -0.000000 Ge\n",
"nsites": 9,
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"elements": [
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],
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"density": 8.56052075321842,
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"volume": 169.0875075223242,
"volume_molar": 11.314097456188835,
"formula_full": "Ho3 Mn3 Ga2 Ge1",
"formula_reduced": "Ho3Mn3Ga2Ge",
"formula_anonymous": "AB2C3D3",
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"spacegroup": 174
},
{
"id": "jvasp-102930",
"created_at": "2022-09-04T14:36:43.904564Z",
"updated_at": "2022-09-04T14:36:43.904588Z",
"structure_string": "Ga1 Ge3\n1.0\n4.299427 -0.000000 0.000000\n0.000000 4.299427 -0.000000\n0.000000 0.000000 4.299427\nGa Ge\n1 3\ndirect\n0.000000 0.000000 0.000000 Ga\n0.000000 0.500000 0.500000 Ge\n0.500000 0.000000 0.500000 Ge\n0.500000 0.500000 0.000000 Ge\n",
"nsites": 4,
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"elements": [
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],
"chemical_system": "Ga-Ge",
"density": 6.009954287427354,
"density_atomic": 0.05033015326993596,
"volume": 79.47521992525594,
"volume_molar": 11.9652740330462,
"formula_full": "Ga1 Ge3",
"formula_reduced": "GaGe3",
"formula_anonymous": "AB3",
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"spacegroup": 221
},
{
"id": "jvasp-107922",
"created_at": "2022-09-04T14:37:50.465896Z",
"updated_at": "2022-09-04T14:37:50.465923Z",
"structure_string": "Ga6 Ge2\n1.0\n6.025792 -0.000000 0.000000\n-3.012895 5.218489 0.000000\n-0.000000 -0.000000 4.959788\nGa Ge\n6 2\ndirect\n0.167567 0.335134 0.250000 Ga\n0.664865 0.832433 0.250000 Ga\n0.167567 0.832433 0.250000 Ga\n0.832432 0.664866 0.750000 Ga\n0.335134 0.167568 0.750000 Ga\n0.832432 0.167568 0.750000 Ga\n0.333333 0.666667 0.750000 Ge\n0.666666 0.333333 0.250000 Ge\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Ga",
"Ge"
],
"chemical_system": "Ga-Ge",
"density": 6.00083837317102,
"density_atomic": 0.05129416501777271,
"volume": 155.9631587185036,
"volume_molar": 11.740401189713124,
"formula_full": "Ga6 Ge2",
"formula_reduced": "Ga3Ge",
"formula_anonymous": "AB3",
"energy_above_hull": 0.0,
"spacegroup": 194
},
{
"id": "jvasp-106512",
"created_at": "2022-09-04T14:36:54.144615Z",
"updated_at": "2022-09-04T14:36:54.144641Z",
"structure_string": "Ga1 Ge3\n1.0\n4.167402 0.000000 2.406051\n1.389134 3.929064 2.406051\n0.000000 0.000000 4.812101\nGa Ge\n1 3\ndirect\n0.000000 0.000000 0.000000 Ga\n0.250000 0.250000 0.250000 Ge\n0.749999 0.749999 0.750000 Ge\n0.499999 0.499999 0.500000 Ge\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Ga",
"Ge"
],
"chemical_system": "Ga-Ge",
"density": 6.06196848425893,
"density_atomic": 0.05076574435325291,
"volume": 78.79328966726148,
"volume_molar": 11.862607032992553,
"formula_full": "Ga1 Ge3",
"formula_reduced": "GaGe3",
"formula_anonymous": "AB3",
"energy_above_hull": 0.5903598,
"spacegroup": 225
},
{
"id": "jvasp-109183",
"created_at": "2022-09-04T14:38:18.044503Z",
"updated_at": "2022-09-04T14:38:18.044535Z",
"structure_string": "Ga1 Ge1\n1.0\n3.541840 -0.000000 2.044882\n1.180613 3.339279 2.044882\n-0.000000 -0.000000 4.089764\nGa Ge\n1 1\ndirect\n0.250000 0.250000 0.250000 Ga\n0.000000 0.000000 0.000000 Ge\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Ga",
"Ge"
],
"chemical_system": "Ga-Ge",
"density": 4.88727004261919,
"density_atomic": 0.041347580676095584,
"volume": 48.37042379014613,
"volume_molar": 14.564675034255634,
"formula_full": "Ga1 Ge1",
"formula_reduced": "GaGe",
"formula_anonymous": "AB",
"energy_above_hull": 0.24688865,
"spacegroup": 216
},
{
"id": "jvasp-39357",
"created_at": "2022-09-04T14:38:02.159245Z",
"updated_at": "2022-09-04T14:38:02.159257Z",
"structure_string": "Ga3 Ge1\n1.0\n4.271333 0.000000 -0.000000\n0.000000 4.271333 0.000000\n-0.000000 0.000000 4.271333\nGa Ge\n3 1\ndirect\n0.000000 0.500000 0.500000 Ga\n0.500000 0.000000 0.500000 Ga\n0.500000 0.500000 0.000000 Ga\n0.000000 0.000000 0.000000 Ge\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Ga",
"Ge"
],
"chemical_system": "Ga-Ge",
"density": 6.005009007552539,
"density_atomic": 0.05132981490448702,
"volume": 77.9274191314167,
"volume_molar": 11.732247176822707,
"formula_full": "Ga3 Ge1",
"formula_reduced": "Ga3Ge",
"formula_anonymous": "AB3",
"energy_above_hull": 0.0042675,
"spacegroup": 221
},
{
"id": "jvasp-100172",
"created_at": "2022-09-04T14:36:31.974786Z",
"updated_at": "2022-09-04T14:36:31.974805Z",
"structure_string": "Ga2 Ge6\n1.0\n6.000990 0.000000 0.000000\n-3.000495 5.197010 0.000000\n0.000000 -0.000000 5.079580\nGa Ge\n2 6\ndirect\n0.333332 0.666667 0.750000 Ga\n0.666667 0.333333 0.250000 Ga\n0.163851 0.327703 0.250000 Ge\n0.672297 0.836149 0.250000 Ge\n0.163851 0.836149 0.250000 Ge\n0.836148 0.672297 0.750000 Ge\n0.327703 0.163851 0.750000 Ge\n0.836148 0.163851 0.750000 Ge\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Ga",
"Ge"
],
"chemical_system": "Ga-Ge",
"density": 6.030157321355924,
"density_atomic": 0.05049934287529949,
"volume": 158.41790297657522,
"volume_molar": 11.925186382861986,
"formula_full": "Ga2 Ge6",
"formula_reduced": "GaGe3",
"formula_anonymous": "AB3",
"energy_above_hull": 0.5962873,
"spacegroup": 194
},
{
"id": "jvasp-79655",
"created_at": "2022-09-04T14:36:42.872696Z",
"updated_at": "2022-09-04T14:36:42.872718Z",
"structure_string": "Ga4\n1.0\n3.877929 2.332415 0.000000\n-3.877929 2.332415 0.000000\n0.000000 0.000000 4.674611\nGa\n4\ndirect\n0.008541 0.334174 0.250000 Ga\n0.665824 0.991457 0.750000 Ga\n0.991457 0.665824 0.750000 Ga\n0.334174 0.008541 0.250000 Ga\n",
"nsites": 4,
"nelements": 1,
"elements": [
"Ga"
],
"chemical_system": "Ga",
"density": 5.476511483543049,
"density_atomic": 0.04730192768390626,
"volume": 84.56314987266232,
"volume_molar": 12.731279791053714,
"formula_full": "Ga4",
"formula_reduced": "Ga",
"formula_anonymous": "A",
"energy_above_hull": 0.0083423249999999,
"spacegroup": 63
},
{
"id": "jvasp-15845",
"created_at": "2022-09-04T14:38:27.348746Z",
"updated_at": "2022-09-04T14:38:27.348772Z",
"structure_string": "Ga2\n1.0\n2.633520 0.000000 -0.938924\n0.000000 3.423521 0.000000\n0.040636 0.000000 4.276724\nGa\n2\ndirect\n0.866754 0.250000 0.733506 Ga\n0.133248 0.750000 0.266494 Ga\n",
"nsites": 2,
"nelements": 1,
"elements": [
"Ga"
],
"chemical_system": "Ga",
"density": 5.985019685185223,
"density_atomic": 0.05169403354418465,
"volume": 38.68918447407537,
"volume_molar": 11.649585739624422,
"formula_full": "Ga2",
"formula_reduced": "Ga",
"formula_anonymous": "A",
"energy_above_hull": 0.024672325,
"spacegroup": 63
},
{
"id": "jvasp-14620",
"created_at": "2022-09-04T14:36:02.841539Z",
"updated_at": "2022-09-04T14:36:02.841564Z",
"structure_string": "Ga1\n1.0\n2.532812 0.000000 -1.349898\n-0.719447 2.428484 -1.349898\n0.022732 0.030443 3.093756\nGa\n1\ndirect\n0.000000 0.000000 0.000000 Ga\n",
"nsites": 1,
"nelements": 1,
"elements": [
"Ga"
],
"chemical_system": "Ga",
"density": 6.018326433168284,
"density_atomic": 0.05198171182062307,
"volume": 19.23753499020521,
"volume_molar": 11.5851143586441,
"formula_full": "Ga1",
"formula_reduced": "Ga",
"formula_anonymous": "A",
"energy_above_hull": 0.042872325,
"spacegroup": 139
},
{
"id": "jvasp-25101",
"created_at": "2022-09-04T14:37:49.288680Z",
"updated_at": "2022-09-04T14:37:49.288701Z",
"structure_string": "Ga4\n1.0\n-2.029111 -2.336372 -0.000000\n-2.029111 2.336372 0.000000\n0.000000 0.000000 -8.112518\nGa\n4\ndirect\n0.748839 0.251160 0.374997 Ga\n0.251160 0.748839 0.625003 Ga\n0.751160 0.248840 0.874997 Ga\n0.248840 0.751160 0.125003 Ga\n",
"nsites": 4,
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"elements": [
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],
"chemical_system": "Ga",
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"density_atomic": 0.052002775583038355,
"volume": 76.9189712501552,
"volume_molar": 11.580421799570695,
"formula_full": "Ga4",
"formula_reduced": "Ga",
"formula_anonymous": "A",
"energy_above_hull": 0.042822325,
"spacegroup": 139
},
{
"id": "jvasp-28346",
"created_at": "2022-09-04T14:37:53.952151Z",
"updated_at": "2022-09-04T14:37:53.952173Z",
"structure_string": "Ga4\n1.0\n-2.030573 -2.334840 0.000000\n-2.030573 2.334840 -0.000000\n0.000000 -0.000000 -8.110651\nGa\n4\ndirect\n0.748524 0.251475 0.375010 Ga\n0.251475 0.748524 0.624989 Ga\n0.751475 0.248524 0.875010 Ga\n0.248524 0.751475 0.124989 Ga\n",
"nsites": 4,
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"elements": [
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"density": 6.021763739626324,
"density_atomic": 0.05201140065118504,
"volume": 76.90621575115884,
"volume_molar": 11.578501414310193,
"formula_full": "Ga4",
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"energy_above_hull": 0.0428123249999999,
"spacegroup": 139
}
]
}