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"next": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-formula_reduced&page=879",
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"results": [
{
"id": "jvasp-107691",
"created_at": "2022-09-04T14:36:51.926367Z",
"updated_at": "2022-09-04T14:36:51.926389Z",
"structure_string": "Sr2 Sn6\n1.0\n6.999783 -0.000000 0.000000\n-3.499891 6.061991 0.000000\n0.000000 -0.000000 5.608990\nSr Sn\n2 6\ndirect\n0.333333 0.666667 0.750000 Sr\n0.666666 0.333333 0.250000 Sr\n0.150247 0.300493 0.250000 Sn\n0.699507 0.849753 0.250000 Sn\n0.150247 0.849753 0.250000 Sn\n0.849753 0.699507 0.750000 Sn\n0.300493 0.150247 0.750000 Sn\n0.849753 0.150247 0.750000 Sn\n",
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"elements": [
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{
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"created_at": "2022-09-04T14:38:15.056306Z",
"updated_at": "2022-09-04T14:38:15.056327Z",
"structure_string": "Sr2 Sn2\n1.0\n4.535458 -0.000000 0.000000\n-0.000000 4.657418 -1.951551\n0.000000 0.005227 6.545762\nSr Sn\n2 2\ndirect\n0.250000 0.864924 0.729846 Sr\n0.750000 0.135077 0.270154 Sr\n0.250000 0.580877 0.161754 Sn\n0.750000 0.419125 0.838247 Sn\n",
"nsites": 4,
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"elements": [
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"density": 4.954155144908867,
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"volume": 138.3158240264922,
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{
"id": "jvasp-108922",
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"structure_string": "Sr1 Sm1 Ni1 O4\n1.0\n3.624164 -0.016708 -5.561214\n-0.333815 3.608797 -5.561214\n0.015305 0.016708 6.637879\nSr Sm Ni O\n1 1 1 4\ndirect\n0.641490 0.641490 0.000001 Sr\n0.363047 0.363047 0.000001 Sm\n0.003717 0.003717 0.000000 Ni\n0.839771 0.839771 0.000001 O\n0.171562 0.171562 0.000000 O\n0.990205 0.490206 0.500000 O\n0.490206 0.990207 0.500002 O\n",
"nsites": 7,
"nelements": 4,
"elements": [
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],
"chemical_system": "Ni-O-Sm-Sr",
"density": 6.848165013618505,
"density_atomic": 0.08004089480933838,
"volume": 87.45529415524862,
"volume_molar": 7.523829880144465,
"formula_full": "Sr1 Sm1 Ni1 O4",
"formula_reduced": "SrSmNiO4",
"formula_anonymous": "ABCD4",
"energy_above_hull": 1.5255873692857147,
"spacegroup": 107
},
{
"id": "jvasp-102676",
"created_at": "2022-09-04T14:36:55.109968Z",
"updated_at": "2022-09-04T14:36:55.109990Z",
"structure_string": "Sr1 Sm1 Al1 O4\n1.0\n3.591778 0.007925 -5.668008\n-0.295751 3.579590 -5.668008\n-0.007281 -0.007925 6.710226\nSr Sm Al O\n1 1 1 4\ndirect\n0.644481 0.644481 0.000001 Sr\n0.360026 0.360026 0.000000 Sm\n0.003111 0.003111 0.000000 Al\n0.838990 0.838991 0.000001 O\n0.167434 0.167434 0.000000 O\n0.992981 0.492981 0.500001 O\n0.492981 0.992980 0.500000 O\n",
"nsites": 7,
"nelements": 4,
"elements": [
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],
"chemical_system": "Al-O-Sm-Sr",
"density": 6.35412467118235,
"density_atomic": 0.08142592829847221,
"volume": 85.96770274869976,
"volume_molar": 7.395851525235841,
"formula_full": "Sr1 Sm1 Al1 O4",
"formula_reduced": "SrSmAlO4",
"formula_anonymous": "ABCD4",
"energy_above_hull": 1.5111302835714289,
"spacegroup": 107
},
{
"id": "jvasp-108666",
"created_at": "2022-09-04T14:38:16.495001Z",
"updated_at": "2022-09-04T14:38:16.495028Z",
"structure_string": "Sr1 Sm3\n1.0\n5.222572 -0.000000 0.000000\n0.000000 5.222572 0.000000\n-0.000000 0.000000 5.222572\nSr Sm\n1 3\ndirect\n0.000000 0.000000 0.000000 Sr\n-0.000000 0.500000 0.500000 Sm\n0.500000 0.000000 0.500000 Sm\n0.500000 0.500000 -0.000000 Sm\n",
"nsites": 4,
"nelements": 2,
"elements": [
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"chemical_system": "Sm-Sr",
"density": 6.279755933870532,
"density_atomic": 0.02808061940618714,
"volume": 142.44700026519573,
"volume_molar": 21.445897160919152,
"formula_full": "Sr1 Sm3",
"formula_reduced": "SrSm3",
"formula_anonymous": "AB3",
"energy_above_hull": 1.0403275833333334,
"spacegroup": 221
},
{
"id": "jvasp-108670",
"created_at": "2022-09-04T14:38:27.557928Z",
"updated_at": "2022-09-04T14:38:27.557956Z",
"structure_string": "Sr1 Sm3\n1.0\n4.765593 -0.016573 -4.255966\n-0.965885 4.666714 -4.255966\n0.013542 0.016573 6.389362\nSr Sm\n1 3\ndirect\n0.000000 0.000000 0.000000 Sr\n0.750000 0.250000 0.499999 Sm\n0.250000 0.749999 0.499999 Sm\n0.500000 0.500000 -0.000001 Sm\n",
"nsites": 4,
"nelements": 2,
"elements": [
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"density": 6.269978181112768,
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"volume": 142.66914004135535,
"volume_molar": 21.479341085929857,
"formula_full": "Sr1 Sm3",
"formula_reduced": "SrSm3",
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"spacegroup": 139
},
{
"id": "jvasp-50144",
"created_at": "2022-09-04T14:36:53.281167Z",
"updated_at": "2022-09-04T14:36:53.281204Z",
"structure_string": "Sr2 Sm4 O8\n1.0\n3.452296 0.000000 0.000000\n-1.726148 5.740508 -0.000000\n0.000000 0.000000 11.342500\nSr Sm O\n2 4 8\ndirect\n0.113598 0.227194 0.250000 Sr\n0.886404 0.772806 0.750000 Sr\n0.367625 0.735249 0.426187 Sm\n0.367625 0.735249 0.073813 Sm\n0.632376 0.264752 0.573813 Sm\n0.632376 0.264752 0.926187 Sm\n0.000000 0.000000 0.000000 O\n0.000000 0.000000 0.500000 O\n0.461754 0.923508 0.250000 O\n0.265189 0.530378 0.611102 O\n0.265189 0.530378 0.888898 O\n0.538246 0.076493 0.750000 O\n0.734812 0.469622 0.388898 O\n0.734812 0.469622 0.111102 O\n",
"nsites": 14,
"nelements": 3,
"elements": [
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"Sm",
"O"
],
"chemical_system": "O-Sm-Sr",
"density": 6.683048964124591,
"density_atomic": 0.06228176279682941,
"volume": 224.78490285622905,
"volume_molar": 9.669188040879554,
"formula_full": "Sr2 Sm4 O8",
"formula_reduced": "SrSm2O4",
"formula_anonymous": "AB2C4",
"energy_above_hull": 1.4846182942857142,
"spacegroup": 63
},
{
"id": "jvasp-49978",
"created_at": "2022-09-04T14:38:12.975865Z",
"updated_at": "2022-09-04T14:38:12.975880Z",
"structure_string": "Sr2 Sm4 O8\n1.0\n0.000000 7.096512 0.000000\n3.548256 -3.548256 5.018741\n7.096512 -0.000000 -0.000000\nSr Sm O\n2 4 8\ndirect\n0.624999 0.750000 0.125000 Sr\n0.375000 0.250000 0.875000 Sr\n-0.000000 0.500000 0.000000 Sm\n0.500000 0.000000 0.500000 Sm\n0.000000 0.000000 0.500000 Sm\n-0.000000 0.500000 0.500000 Sm\n0.765315 0.030644 0.265252 O\n0.765251 0.469356 0.265331 O\n0.204103 0.469356 0.265315 O\n0.234669 0.969356 0.295897 O\n0.765330 0.030644 0.704103 O\n0.795896 0.530644 0.734685 O\n0.234748 0.530644 0.734670 O\n0.234685 0.969356 0.734749 O\n",
"nsites": 14,
"nelements": 3,
"elements": [
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"Sm",
"O"
],
"chemical_system": "O-Sm-Sr",
"density": 5.94370321463301,
"density_atomic": 0.055391530981700035,
"volume": 252.7462186344921,
"volume_molar": 10.871952179818903,
"formula_full": "Sr2 Sm4 O8",
"formula_reduced": "SrSm2O4",
"formula_anonymous": "AB2C4",
"energy_above_hull": 1.4851482942857142,
"spacegroup": 227
},
{
"id": "jvasp-111003",
"created_at": "2022-09-04T14:38:36.539069Z",
"updated_at": "2022-09-04T14:38:36.539088Z",
"structure_string": "Sr1 Si2 Pt2\n1.0\n4.040378 -0.024372 -4.373411\n-0.636114 3.990064 -4.373411\n0.020921 0.024372 5.954069\nSr Si Pt\n1 2 2\ndirect\n0.000000 0.000000 0.000000 Sr\n0.250001 0.749999 0.500000 Si\n0.750000 0.250000 0.500000 Si\n0.640188 0.640187 0.000001 Pt\n0.359813 0.359812 0.000000 Pt\n",
"nsites": 5,
"nelements": 3,
"elements": [
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"Si",
"Pt"
],
"chemical_system": "Pt-Si-Sr",
"density": 9.163382423616605,
"density_atomic": 0.05167361053170679,
"volume": 96.76118909732489,
"volume_molar": 11.654190016981357,
"formula_full": "Sr1 Si2 Pt2",
"formula_reduced": "Sr(SiPt)2",
"formula_anonymous": "AB2C2",
"energy_above_hull": 2.156075262,
"spacegroup": 139
},
{
"id": "jvasp-110922",
"created_at": "2022-09-04T14:38:46.769124Z",
"updated_at": "2022-09-04T14:38:46.769156Z",
"structure_string": "Sr1 Si2 Pt2\n1.0\n4.005111 -0.053709 -4.301045\n-0.659082 3.950875 -4.301045\n0.046114 0.053709 5.876885\nSr Si Pt\n1 2 2\ndirect\n0.000000 0.000000 0.000000 Sr\n0.371343 0.371343 0.000000 Si\n0.628657 0.628656 0.000000 Si\n0.749999 0.250000 0.500000 Pt\n0.250000 0.749999 0.500000 Pt\n",
"nsites": 5,
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"elements": [
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],
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"density": 9.367011292076477,
"density_atomic": 0.05282190254391059,
"volume": 94.6577037024277,
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"formula_full": "Sr1 Si2 Pt2",
"formula_reduced": "Sr(SiPt)2",
"formula_anonymous": "AB2C2",
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"spacegroup": 139
},
{
"id": "jvasp-92397",
"created_at": "2022-09-04T14:36:02.511172Z",
"updated_at": "2022-09-04T14:36:02.511198Z",
"structure_string": "Sr1 Si2 Pd2\n1.0\n4.040174 -0.000000 -1.615993\n-0.646368 3.988134 -1.615993\n0.002617 0.003075 5.864992\nSr Si Pd\n1 2 2\ndirect\n0.000000 0.000000 0.000000 Sr\n0.373508 0.373508 0.747016 Si\n0.626492 0.626492 0.252984 Si\n0.750000 0.250000 0.500000 Pd\n0.250000 0.750000 0.500000 Pd\n",
"nsites": 5,
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"elements": [
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],
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"density": 6.2639236752807435,
"density_atomic": 0.05288691966692908,
"volume": 94.5413352013876,
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"formula_full": "Sr1 Si2 Pd2",
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"formula_anonymous": "AB2C2",
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"spacegroup": 139
},
{
"id": "jvasp-87119",
"created_at": "2022-09-04T14:35:53.583628Z",
"updated_at": "2022-09-04T14:35:53.583655Z",
"structure_string": "Sr4 Si4 Pd4\n1.0\n6.552286 0.000000 -0.000000\n0.000000 6.552286 0.000000\n-0.000000 0.000000 6.552286\nSr Si Pd\n4 4 4\ndirect\n0.628878 0.371122 0.871123 Sr\n0.371122 0.871123 0.628878 Sr\n0.128878 0.128878 0.128878 Sr\n0.871123 0.628878 0.371122 Sr\n0.164510 0.335491 0.664510 Si\n0.664510 0.164510 0.335491 Si\n0.335491 0.664510 0.164510 Si\n0.835491 0.835491 0.835491 Si\n0.588355 0.911646 0.088355 Pd\n0.088355 0.588355 0.911646 Pd\n0.411646 0.411646 0.411646 Pd\n0.911646 0.088355 0.588355 Pd\n",
"nsites": 12,
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"elements": [
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],
"chemical_system": "Pd-Si-Sr",
"density": 5.244800463651866,
"density_atomic": 0.04265821798191546,
"volume": 281.3057030438375,
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"formula_full": "Sr4 Si4 Pd4",
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"formula_anonymous": "ABC",
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"spacegroup": 198
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]
}