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{
"count": 55712,
"next": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-elements&page=4058",
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"results": [
{
"id": "jvasp-35788",
"created_at": "2022-09-04T14:37:27.831472Z",
"updated_at": "2022-09-04T14:37:27.831493Z",
"structure_string": "Mn1 Sn1\n1.0\n3.047028 3.047028 0.000000\n3.047028 -0.000000 -3.047028\n-0.000000 3.047028 -3.047028\nMn Sn\n1 1\ndirect\n0.000000 0.000000 0.000000 Mn\n0.750001 0.750001 0.750001 Sn\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Mn",
"Sn"
],
"chemical_system": "Mn-Sn",
"density": 5.096354911062087,
"density_atomic": 0.03534847357243706,
"volume": 56.579529407445136,
"volume_molar": 17.036494511309698,
"formula_full": "Mn1 Sn1",
"formula_reduced": "MnSn",
"formula_anonymous": "AB",
"energy_above_hull": 1.9719194706896548,
"spacegroup": 216
},
{
"id": "jvasp-38226",
"created_at": "2022-09-04T14:36:07.715022Z",
"updated_at": "2022-09-04T14:36:07.715047Z",
"structure_string": "Mn2 Sn6\n1.0\n3.199216 -5.541206 -0.000000\n3.199216 5.541206 -0.000000\n-0.000000 0.000000 5.506910\nMn Sn\n2 6\ndirect\n0.333333 0.666668 0.750000 Mn\n0.666668 0.333333 0.250000 Mn\n0.657855 0.828929 0.250000 Sn\n0.171073 0.828929 0.250000 Sn\n0.171072 0.342146 0.250000 Sn\n0.342146 0.171072 0.750000 Sn\n0.828929 0.171073 0.750000 Sn\n0.828929 0.657855 0.750000 Sn\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Mn",
"Sn"
],
"chemical_system": "Mn-Sn",
"density": 6.992089476640183,
"density_atomic": 0.04097360284903033,
"volume": 195.24765809529796,
"volume_molar": 14.697611001377972,
"formula_full": "Mn2 Sn6",
"formula_reduced": "MnSn3",
"formula_anonymous": "AB3",
"energy_above_hull": 1.4546305853448276,
"spacegroup": 194
},
{
"id": "jvasp-107677",
"created_at": "2022-09-04T14:36:59.265910Z",
"updated_at": "2022-09-04T14:36:59.265937Z",
"structure_string": "Mn1 Sn3\n1.0\n4.190063 0.230075 -4.273448\n-0.538580 4.161670 -4.273448\n-0.191294 -0.230075 5.981839\nMn Sn\n1 3\ndirect\n0.000000 0.000000 0.000000 Mn\n0.750000 0.250000 0.500000 Sn\n0.250000 0.750000 0.500000 Sn\n0.500000 0.500001 -0.000000 Sn\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Mn",
"Sn"
],
"chemical_system": "Mn-Sn",
"density": 7.023501235851279,
"density_atomic": 0.041157675571641315,
"volume": 97.18721828781074,
"volume_molar": 14.63187771505106,
"formula_full": "Mn1 Sn3",
"formula_reduced": "MnSn3",
"formula_anonymous": "AB3",
"energy_above_hull": 1.4501930853448275,
"spacegroup": 139
},
{
"id": "jvasp-37178",
"created_at": "2022-09-04T14:35:53.277274Z",
"updated_at": "2022-09-04T14:35:53.277299Z",
"structure_string": "Mn2 Sn2\n1.0\n2.024427 -3.506410 -0.000000\n2.024427 3.506410 0.000000\n-0.000000 0.000000 5.570241\nMn Sn\n2 2\ndirect\n0.000000 0.000000 0.500000 Mn\n0.000000 0.000000 0.000000 Mn\n0.333334 0.666668 0.250000 Sn\n0.666668 0.333334 0.750000 Sn\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Mn",
"Sn"
],
"chemical_system": "Mn-Sn",
"density": 7.292563055229241,
"density_atomic": 0.05058144044747854,
"volume": 79.08038926161895,
"volume_molar": 11.905830887226545,
"formula_full": "Mn2 Sn2",
"formula_reduced": "MnSn",
"formula_anonymous": "AB",
"energy_above_hull": 1.649199470689655,
"spacegroup": 194
},
{
"id": "jvasp-17596",
"created_at": "2022-09-04T14:38:16.588645Z",
"updated_at": "2022-09-04T14:38:16.588658Z",
"structure_string": "Mn2 Sn4\n1.0\n4.710367 -0.000000 2.717506\n2.355183 4.699259 1.358753\n0.006866 -0.000000 5.429189\nMn Sn\n2 4\ndirect\n0.250000 0.000000 0.000000 Mn\n0.750000 0.000000 0.000000 Mn\n0.335169 0.829664 0.500000 Sn\n0.835169 0.500000 0.829664 Sn\n0.164831 0.500000 0.170336 Sn\n0.664832 0.170336 0.500000 Sn\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Mn",
"Sn"
],
"chemical_system": "Mn-Sn",
"density": 8.085223523100668,
"density_atomic": 0.04996307265873427,
"volume": 120.08869112158402,
"volume_molar": 12.053183360305688,
"formula_full": "Mn2 Sn4",
"formula_reduced": "MnSn2",
"formula_anonymous": "AB2",
"energy_above_hull": 1.5241368804597704,
"spacegroup": 140
},
{
"id": "jvasp-93367",
"created_at": "2022-09-04T14:36:15.214343Z",
"updated_at": "2022-09-04T14:36:15.214356Z",
"structure_string": "Mn2 Sn4\n1.0\n-3.323702 3.323702 -2.718389\n3.323702 -3.323702 -2.718389\n-3.323702 -3.323702 2.718389\nMn Sn\n2 4\ndirect\n0.750000 0.750000 0.000000 Mn\n0.250000 0.250000 0.000000 Mn\n0.835183 0.335183 0.170366 Sn\n0.164817 0.664816 0.829633 Sn\n0.664817 0.835183 0.500000 Sn\n0.335183 0.164817 0.500000 Sn\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Mn",
"Sn"
],
"chemical_system": "Mn-Sn",
"density": 8.083108155729063,
"density_atomic": 0.04995000063253914,
"volume": 120.12011859898546,
"volume_molar": 12.056337705183074,
"formula_full": "Mn2 Sn4",
"formula_reduced": "MnSn2",
"formula_anonymous": "AB2",
"energy_above_hull": 1.5240768804597704,
"spacegroup": 140
},
{
"id": "jvasp-35684",
"created_at": "2022-09-04T14:37:16.862970Z",
"updated_at": "2022-09-04T14:37:16.862999Z",
"structure_string": "Mn3 Sn1\n1.0\n3.014031 3.014031 -0.000000\n3.014031 -0.000000 -3.014031\n-0.000000 3.014031 -3.014031\nMn Sn\n3 1\ndirect\n0.250000 0.250000 0.250000 Mn\n0.750000 0.750000 0.750000 Mn\n0.500000 0.500000 0.500000 Mn\n0.000000 0.000000 0.000000 Sn\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Mn",
"Sn"
],
"chemical_system": "Mn-Sn",
"density": 8.597377400897859,
"density_atomic": 0.073044387410535,
"volume": 54.76122316583479,
"volume_molar": 8.244494852360749,
"formula_full": "Mn3 Sn1",
"formula_reduced": "Mn3Sn",
"formula_anonymous": "AB3",
"energy_above_hull": 3.330998356034482,
"spacegroup": 225
},
{
"id": "jvasp-36320",
"created_at": "2022-09-04T14:37:18.437527Z",
"updated_at": "2022-09-04T14:37:18.437550Z",
"structure_string": "Mn1 Sn1\n1.0\n3.161351 -0.000000 -0.000000\n0.000000 3.161351 -0.000000\n0.000000 -0.000000 3.161351\nMn Sn\n1 1\ndirect\n0.000000 0.000000 0.000000 Mn\n0.500000 0.500000 0.500000 Sn\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Mn",
"Sn"
],
"chemical_system": "Mn-Sn",
"density": 9.12642823185338,
"density_atomic": 0.06330118541473034,
"volume": 31.594984942171322,
"volume_molar": 9.513472331591808,
"formula_full": "Mn1 Sn1",
"formula_reduced": "MnSn",
"formula_anonymous": "AB",
"energy_above_hull": 1.798139470689655,
"spacegroup": 221
},
{
"id": "jvasp-35779",
"created_at": "2022-09-04T14:37:19.394027Z",
"updated_at": "2022-09-04T14:37:19.394059Z",
"structure_string": "Mn1 Sn1\n1.0\n2.745690 2.745690 0.000000\n2.745690 -0.000000 -2.745690\n0.000000 2.745690 -2.745690\nMn Sn\n1 1\ndirect\n0.000000 0.000000 0.000000 Mn\n0.500000 0.500000 0.500000 Sn\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Mn",
"Sn"
],
"chemical_system": "Mn-Sn",
"density": 6.965214477529723,
"density_atomic": 0.04831094069820287,
"volume": 41.398490095524025,
"volume_molar": 12.465376730335578,
"formula_full": "Mn1 Sn1",
"formula_reduced": "MnSn",
"formula_anonymous": "AB",
"energy_above_hull": 1.7386644706896548,
"spacegroup": 225
},
{
"id": "jvasp-18209",
"created_at": "2022-09-04T14:38:11.654371Z",
"updated_at": "2022-09-04T14:38:11.654401Z",
"structure_string": "Mn6 Sn2\n1.0\n2.725467 -4.720647 0.000000\n2.725467 4.720647 -0.000000\n-0.000000 -0.000000 4.292526\nMn Sn\n6 2\ndirect\n0.299523 0.149761 0.750001 Mn\n0.149761 0.850240 0.250000 Mn\n0.149761 0.299523 0.250000 Mn\n0.850240 0.700479 0.750001 Mn\n0.850240 0.149761 0.750001 Mn\n0.700479 0.850240 0.250000 Mn\n0.333333 0.666668 0.750001 Sn\n0.666668 0.333333 0.250000 Sn\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Mn",
"Sn"
],
"chemical_system": "Mn-Sn",
"density": 8.524791057511909,
"density_atomic": 0.07242768481161875,
"volume": 110.45500102354025,
"volume_molar": 8.314694547621293,
"formula_full": "Mn6 Sn2",
"formula_reduced": "Mn3Sn",
"formula_anonymous": "AB3",
"energy_above_hull": 3.327405856034482,
"spacegroup": 194
},
{
"id": "jvasp-98116",
"created_at": "2022-09-04T14:36:15.338075Z",
"updated_at": "2022-09-04T14:36:15.338094Z",
"structure_string": "Mn40 Si16\n1.0\n8.474242 -0.000000 0.000000\n-0.000000 8.686537 -0.000000\n-0.000000 0.000000 8.686537\nMn Si\n40 16\ndirect\n0.000000 0.866691 0.866691 Mn\n0.848744 0.220925 0.175200 Mn\n0.534847 0.868149 0.042612 Mn\n0.284847 0.542612 0.631851 Mn\n0.329234 0.422076 0.184200 Mn\n0.929449 0.005862 0.399218 Mn\n0.250000 0.633309 0.366691 Mn\n0.679449 0.899218 0.494138 Mn\n0.820551 0.505862 0.100782 Mn\n0.570551 0.600782 0.994138 Mn\n0.420766 0.922076 0.315800 Mn\n0.401256 0.279075 0.675200 Mn\n0.098744 0.324801 0.720926 Mn\n0.429449 0.994138 0.600782 Mn\n0.465153 0.042612 0.868149 Mn\n0.750000 0.366691 0.633309 Mn\n0.348744 0.779075 0.824801 Mn\n0.965153 0.957389 0.131851 Mn\n0.670766 0.184200 0.422076 Mn\n0.651256 0.824801 0.779075 Mn\n0.750000 0.045276 0.954724 Mn\n0.598744 0.675200 0.279075 Mn\n0.000000 0.545276 0.545276 Mn\n0.179449 0.100782 0.505862 Mn\n0.784847 0.457388 0.368149 Mn\n0.250000 0.954724 0.045276 Mn\n0.170766 0.815800 0.577925 Mn\n0.034847 0.131851 0.957389 Mn\n0.151256 0.175200 0.220925 Mn\n0.079234 0.684200 0.077924 Mn\n0.715153 0.631851 0.542612 Mn\n0.901256 0.720926 0.324801 Mn\n0.579234 0.315800 0.922076 Mn\n0.215153 0.368149 0.457388 Mn\n0.070551 0.399218 0.005862 Mn\n0.320551 0.494138 0.899218 Mn\n0.829234 0.577925 0.815800 Mn\n0.920766 0.077924 0.684200 Mn\n0.500000 0.133309 0.133309 Mn\n0.500000 0.454724 0.454724 Mn\n0.298366 0.236105 0.965686 Si\n0.401768 0.195946 0.379892 Si\n0.451634 0.736105 0.534315 Si\n0.701634 0.965686 0.236105 Si\n0.798366 0.763895 0.034315 Si\n0.548366 0.534315 0.736105 Si\n0.098232 0.620108 0.804055 Si\n0.848232 0.304055 0.879893 Si\n0.201634 0.034315 0.763895 Si\n0.048366 0.465685 0.263895 Si\n0.151768 0.879893 0.304055 Si\n0.901768 0.804055 0.620108 Si\n0.348232 0.695946 0.120108 Si\n0.598232 0.379892 0.195946 Si\n0.651768 0.120108 0.695946 Si\n0.951634 0.263895 0.465685 Si\n",
"nsites": 56,
"nelements": 2,
"elements": [
"Mn",
"Si"
],
"chemical_system": "Mn-Si",
"density": 6.8737027614284,
"density_atomic": 0.08757775683814048,
"volume": 639.4317692276376,
"volume_molar": 6.876335929829769,
"formula_full": "Mn40 Si16",
"formula_reduced": "Mn5Si2",
"formula_anonymous": "A2B5",
"energy_above_hull": 4.447666200985221,
"spacegroup": 92
},
{
"id": "jvasp-57640",
"created_at": "2022-09-04T14:37:54.064780Z",
"updated_at": "2022-09-04T14:37:54.064808Z",
"structure_string": "Mn10 Si6\n1.0\n3.370552 -5.837967 -0.000000\n3.370552 5.837967 0.000000\n-0.000000 0.000000 4.601316\nMn Si\n10 6\ndirect\n0.235602 0.235602 0.750001 Mn\n0.764397 0.764397 0.250000 Mn\n0.235602 -0.000000 0.250000 Mn\n-0.000000 0.764398 0.750001 Mn\n0.764398 -0.000000 0.750001 Mn\n-0.000000 0.235602 0.250000 Mn\n0.333333 0.666667 0.500000 Mn\n0.666667 0.333333 0.000000 Mn\n0.666667 0.333333 0.500000 Mn\n0.333333 0.666667 0.000000 Mn\n-0.000000 0.392919 0.750001 Si\n0.607081 -0.000000 0.250000 Si\n0.392919 0.392919 0.250000 Si\n0.607080 0.607080 0.750001 Si\n0.392919 -0.000000 0.750001 Si\n-0.000000 0.607081 0.250000 Si\n",
"nsites": 16,
"nelements": 2,
"elements": [
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"Si"
],
"chemical_system": "Mn-Si",
"density": 6.583159315316855,
"density_atomic": 0.08835787440276814,
"volume": 181.08176671460015,
"volume_molar": 6.81562430140503,
"formula_full": "Mn10 Si6",
"formula_reduced": "Mn5Si3",
"formula_anonymous": "A3B5",
"energy_above_hull": 4.424529000862068,
"spacegroup": 193
}
]
}