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{
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"next": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-chemical_system&page=62",
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"results": [
{
"id": "jvasp-101121",
"created_at": "2022-09-04T14:37:04.226790Z",
"updated_at": "2022-09-04T14:37:04.226805Z",
"structure_string": "Sm2 Sb1 S1\n1.0\n4.259115 -0.000000 0.000000\n0.000000 4.259115 0.000000\n0.000000 -0.000000 6.024393\nSm Sb S\n2 1 1\ndirect\n0.000000 0.000000 0.500000 Sm\n0.500001 0.500001 -0.000000 Sm\n0.000000 0.000000 0.000000 Sb\n0.500001 0.500001 0.500000 S\n",
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{
"id": "jvasp-119151",
"created_at": "2022-09-04T14:38:35.649070Z",
"updated_at": "2022-09-04T14:38:35.649087Z",
"structure_string": "Sb8 Se6 S6\n1.0\n3.968504 -0.000000 0.000000\n0.000000 11.394474 0.000000\n0.000000 -0.000000 11.661660\nSb Se S\n8 6 6\ndirect\n0.500000 0.205663 0.651850 Sb\n0.500000 0.794336 0.151850 Sb\n-0.000000 0.291226 0.346843 Sb\n-0.000000 0.708773 0.846843 Sb\n-0.000000 0.920498 0.529586 Sb\n-0.000000 0.079502 0.029586 Sb\n0.500000 0.589544 0.475917 Sb\n0.500000 0.410456 0.975917 Sb\n0.500000 0.884458 0.942490 Se\n0.500000 0.115542 0.442490 Se\n-0.000000 0.619716 0.057096 Se\n0.500000 0.546855 0.781908 Se\n0.500000 0.453144 0.281908 Se\n-0.000000 0.380284 0.557096 Se\n-0.000000 0.053669 0.709760 S\n0.500000 0.807809 0.625740 S\n0.500000 0.192190 0.125740 S\n-0.000000 0.699128 0.378811 S\n-0.000000 0.300872 0.878811 S\n-0.000000 0.946330 0.209760 S\n",
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"formula_full": "Sb8 Se6 S6",
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"formula_anonymous": "A3B3C4",
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"spacegroup": 26
},
{
"id": "jvasp-8396",
"created_at": "2022-09-04T14:37:06.591155Z",
"updated_at": "2022-09-04T14:37:06.591182Z",
"structure_string": "Sb2 S4\n1.0\n4.906272 -0.000000 -2.231425\n-1.014875 4.800158 -2.231425\n0.238424 0.294102 7.033689\nSb S\n2 4\ndirect\n0.250000 0.750000 0.500000 Sb\n0.000000 0.000000 0.000000 Sb\n0.837663 0.875000 0.250000 S\n0.624999 0.162337 0.750000 S\n0.412337 0.375000 0.250000 S\n0.125000 0.587663 0.750000 S\n",
"nsites": 6,
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"elements": [
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"density": 3.58741348272301,
"density_atomic": 0.03486563392018772,
"volume": 172.0892272813635,
"volume_molar": 17.272425832800053,
"formula_full": "Sb2 S4",
"formula_reduced": "SbS2",
"formula_anonymous": "AB2",
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"spacegroup": 122
},
{
"id": "jvasp-19010",
"created_at": "2022-09-04T14:37:07.723870Z",
"updated_at": "2022-09-04T14:37:07.723900Z",
"structure_string": "Sb8 S12\n1.0\n3.889722 0.000000 0.000000\n0.000000 11.198930 0.000000\n0.000000 0.000000 11.472696\nSb S\n8 12\ndirect\n0.750000 0.464686 0.849747 Sb\n0.250000 0.535314 0.150253 Sb\n0.250000 0.964686 0.650253 Sb\n0.750000 0.035314 0.349747 Sb\n0.250000 0.173237 0.974329 Sb\n0.750000 0.826763 0.025672 Sb\n0.750000 0.673237 0.525672 Sb\n0.250000 0.326763 0.474329 Sb\n0.750000 0.807931 0.707934 S\n0.250000 0.192069 0.292066 S\n0.750000 0.125154 0.549791 S\n0.250000 0.874846 0.450210 S\n0.250000 0.625154 0.950210 S\n0.250000 0.940666 0.124163 S\n0.750000 0.440666 0.375837 S\n0.250000 0.559334 0.624163 S\n0.750000 0.692069 0.207934 S\n0.750000 0.059334 0.875838 S\n0.750000 0.374846 0.049790 S\n0.250000 0.307931 0.792066 S\n",
"nsites": 20,
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"elements": [
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"density": 4.515056954114765,
"density_atomic": 0.04001929341726501,
"volume": 499.7589485518417,
"volume_molar": 15.048093671243942,
"formula_full": "Sb8 S12",
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"spacegroup": 62
},
{
"id": "jvasp-79582",
"created_at": "2022-09-04T14:37:12.589113Z",
"updated_at": "2022-09-04T14:37:12.589123Z",
"structure_string": "Sb2 S2\n1.0\n2.704086 -3.034872 0.100933\n-3.168137 -2.889360 -2.016785\n-2.332104 -2.325504 -7.653739\nSb S\n2 2\ndirect\n0.750155 0.106714 0.653363 Sb\n0.249845 0.893284 0.346638 Sb\n0.250272 0.569591 0.755724 S\n0.749728 0.430407 0.244276 S\n",
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"volume": 106.49628149626757,
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"spacegroup": 11
},
{
"id": "jvasp-4285",
"created_at": "2022-09-04T14:38:02.159002Z",
"updated_at": "2022-09-04T14:38:02.159019Z",
"structure_string": "Sb8 S12\n1.0\n3.889911 0.000000 0.000000\n0.000000 11.199032 0.000000\n0.000000 0.000000 11.472339\nSb S\n8 12\ndirect\n0.750000 0.964672 0.349747 Sb\n0.250000 0.035328 0.650253 Sb\n0.250000 0.464672 0.150253 Sb\n0.750000 0.535328 0.849747 Sb\n0.250000 0.673232 0.474348 Sb\n0.750000 0.326768 0.525653 Sb\n0.750000 0.173232 0.025652 Sb\n0.250000 0.826768 0.974348 Sb\n0.750000 0.307923 0.207929 S\n0.250000 0.692076 0.792071 S\n0.750000 0.625150 0.049795 S\n0.250000 0.374849 0.950205 S\n0.250000 0.125150 0.450205 S\n0.250000 0.440665 0.624157 S\n0.750000 0.940664 0.875843 S\n0.250000 0.059335 0.124157 S\n0.750000 0.192077 0.707929 S\n0.750000 0.559335 0.375843 S\n0.750000 0.874849 0.549795 S\n0.250000 0.807923 0.292071 S\n",
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"elements": [
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"density": 4.514936952093696,
"density_atomic": 0.04001822977706276,
"volume": 499.7722315908985,
"volume_molar": 15.048493632898548,
"formula_full": "Sb8 S12",
"formula_reduced": "Sb2S3",
"formula_anonymous": "A2B3",
"energy_above_hull": 1.83011044,
"spacegroup": 62
},
{
"id": "jvasp-51173",
"created_at": "2022-09-04T14:36:59.119737Z",
"updated_at": "2022-09-04T14:36:59.119768Z",
"structure_string": "Sr1 Zr1 Zn1\n1.0\n0.000000 3.467157 3.467157\n3.467157 0.000000 3.467157\n3.467157 3.467157 0.000000\nSr Zr Zn\n1 1 1\ndirect\n0.000000 0.000000 0.000000 Sr\n0.250000 0.250000 0.250000 Zr\n0.500000 0.500000 0.500000 Zn\n",
"nsites": 3,
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"elements": [
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"Zr",
"Zn"
],
"chemical_system": "Sr-Zn-Zr",
"density": 4.86562332602049,
"density_atomic": 0.035989079230831215,
"volume": 83.35862056259423,
"volume_molar": 16.73324488624576,
"formula_full": "Sr1 Zr1 Zn1",
"formula_reduced": "SrZrZn",
"formula_anonymous": "ABC",
"energy_above_hull": 0.9053070700000002,
"spacegroup": 216
},
{
"id": "jvasp-86932",
"created_at": "2022-09-04T14:35:48.112659Z",
"updated_at": "2022-09-04T14:35:48.112685Z",
"structure_string": "Sr1 Zn5\n1.0\n5.557717 0.000000 0.000000\n-2.778858 4.813124 -0.000000\n0.000000 0.000000 4.260156\nSr Zn\n1 5\ndirect\n0.000000 0.000000 0.000000 Sr\n0.666667 0.333333 0.000000 Zn\n0.500000 0.000000 0.500000 Zn\n0.500000 0.500000 0.500000 Zn\n-0.000000 0.500000 0.500000 Zn\n0.333333 0.666666 0.000000 Zn\n",
"nsites": 6,
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"elements": [
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"volume": 113.95909238893626,
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"formula_full": "Sr1 Zn5",
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"formula_anonymous": "AB5",
"energy_above_hull": 0.0,
"spacegroup": 191
},
{
"id": "jvasp-109597",
"created_at": "2022-09-04T14:38:18.922671Z",
"updated_at": "2022-09-04T14:38:18.922697Z",
"structure_string": "Sr3 Zn1\n1.0\n5.393564 -0.000000 0.000000\n0.000000 5.393564 0.000000\n-0.000000 -0.000000 5.393564\nSr Zn\n3 1\ndirect\n0.500000 0.000000 0.500000 Sr\n0.500000 0.500000 -0.000000 Sr\n-0.000000 0.500000 0.500000 Sr\n0.000000 0.000000 0.000000 Zn\n",
"nsites": 4,
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"elements": [
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"density_atomic": 0.02549367717271959,
"volume": 156.90164949136255,
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"formula_anonymous": "AB3",
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"spacegroup": 221
},
{
"id": "jvasp-88948",
"created_at": "2022-09-04T14:35:47.758960Z",
"updated_at": "2022-09-04T14:35:47.758989Z",
"structure_string": "Sr4 Zn8\n1.0\n5.884231 -0.000000 0.000000\n-2.942115 5.095893 -0.000000\n0.000000 -0.000000 9.062316\nSr Zn\n4 8\ndirect\n0.333332 0.666667 0.446108 Sr\n0.666667 0.333333 0.946108 Sr\n0.666667 0.333333 0.553893 Sr\n0.333332 0.666667 0.053892 Sr\n0.159319 0.318638 0.750000 Zn\n0.840681 0.159319 0.250000 Zn\n0.318638 0.159319 0.250000 Zn\n0.681361 0.840680 0.750000 Zn\n0.000000 0.000000 0.000000 Zn\n0.000000 0.000000 0.500000 Zn\n0.840680 0.681362 0.250000 Zn\n0.159318 0.840680 0.750000 Zn\n",
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"density": 5.33934599382888,
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"formula_full": "Sr4 Zn8",
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"spacegroup": 194
},
{
"id": "jvasp-56213",
"created_at": "2022-09-04T14:37:29.751803Z",
"updated_at": "2022-09-04T14:37:29.751827Z",
"structure_string": "Sr2 Zn4\n1.0\n4.350909 0.000000 1.883170\n2.164397 5.505061 0.967131\n-0.011249 0.010210 5.993783\nSr Zn\n2 4\ndirect\n0.953411 0.796590 0.296589 Sr\n0.046590 0.203410 0.703410 Sr\n0.334971 0.224866 0.105193 Zn\n0.665030 0.775134 0.894806 Zn\n0.334971 0.605193 0.724866 Zn\n0.665030 0.394807 0.275134 Zn\n",
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"spacegroup": 74
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{
"id": "jvasp-90471",
"created_at": "2022-09-04T14:35:54.600377Z",
"updated_at": "2022-09-04T14:35:54.600397Z",
"structure_string": "Sr4 Zn4\n1.0\n4.681224 0.000000 0.000000\n-0.000000 6.266820 0.000000\n0.000000 0.000000 8.448737\nSr Zn\n4 4\ndirect\n0.250000 0.379403 0.679549 Sr\n0.749999 0.620597 0.320452 Sr\n0.749999 0.879403 0.820452 Sr\n0.250000 0.120597 0.179548 Sr\n0.250000 0.892113 0.529343 Zn\n0.749999 0.107887 0.470658 Zn\n0.749999 0.392113 0.970658 Zn\n0.250000 0.607887 0.029343 Zn\n",
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}
]
}