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=density_atomic&page=662",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=density_atomic&page=660",
"results": [
{
"id": "jvasp-9744",
"created_at": "2022-09-04T14:37:35.596217Z",
"updated_at": "2022-09-04T14:37:35.596240Z",
"structure_string": "Tl4 Ag4 Te4\n1.0\n4.910599 -0.000000 0.000000\n0.000000 8.036446 0.000000\n0.000000 0.000000 8.673679\nTl Ag Te\n4 4 4\ndirect\n0.250000 0.179447 0.987353 Tl\n0.750000 0.679447 0.512647 Tl\n0.250000 0.320553 0.487353 Tl\n0.750000 0.820554 0.012647 Tl\n0.250000 0.587968 0.170657 Ag\n0.750000 0.412032 0.829343 Ag\n0.750000 0.087968 0.329343 Ag\n0.250000 0.912032 0.670657 Ag\n0.750000 0.403383 0.187039 Te\n0.750000 0.096617 0.687039 Te\n0.250000 0.596618 0.812962 Te\n0.250000 0.903383 0.312961 Te\n",
"nsites": 12,
"nelements": 3,
"elements": [
"Tl",
"Ag",
"Te"
],
"chemical_system": "Ag-Te-Tl",
"density": 8.535192465168818,
"density_atomic": 0.03505737535738821,
"volume": 342.29601838892495,
"volume_molar": 17.17795670271379,
"formula_full": "Tl4 Ag4 Te4",
"formula_reduced": "TlAgTe",
"formula_anonymous": "ABC",
"energy_above_hull": 0.0060669207407406,
"spacegroup": 62
},
{
"id": "jvasp-65569",
"created_at": "2022-09-04T14:35:58.912143Z",
"updated_at": "2022-09-04T14:35:58.912169Z",
"structure_string": "Ba1 Mn2 Cl1\n1.0\n4.190884 0.000000 0.000000\n0.000000 4.190884 0.000000\n0.000000 -0.000000 6.496263\nBa Mn Cl\n1 2 1\ndirect\n0.500000 0.500000 0.500000 Ba\n0.000000 0.500000 0.000000 Mn\n0.500000 0.000000 0.000000 Mn\n0.000000 0.000000 0.500000 Cl\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ba",
"Mn",
"Cl"
],
"chemical_system": "Ba-Cl-Mn",
"density": 4.113699513767161,
"density_atomic": 0.03505783657420651,
"volume": 114.09717172744665,
"volume_molar": 17.177730711514403,
"formula_full": "Ba1 Mn2 Cl1",
"formula_reduced": "BaMn2Cl",
"formula_anonymous": "ABC2",
"energy_above_hull": 2.1055261300646557,
"spacegroup": 123
},
{
"id": "jvasp-24650",
"created_at": "2022-09-04T14:37:07.680344Z",
"updated_at": "2022-09-04T14:37:07.680365Z",
"structure_string": "Ba4 Hg4 S8\n1.0\n4.251001 0.000000 0.000000\n0.000000 7.396571 0.000000\n0.000000 0.000000 14.514128\nBa Hg S\n4 4 8\ndirect\n0.000000 0.005991 0.898348 Ba\n0.000000 0.681071 0.609009 Ba\n0.000000 0.505990 0.101653 Ba\n0.000000 0.181071 0.390991 Ba\n0.500000 0.662704 0.353116 Hg\n0.500000 0.162704 0.646884 Hg\n0.500000 0.003634 0.143234 Hg\n0.500000 0.503634 0.856766 Hg\n0.500000 0.389507 0.530331 S\n0.500000 0.889507 0.469669 S\n0.000000 0.886882 0.224774 S\n0.000000 0.386882 0.775226 S\n0.500000 0.395395 0.261673 S\n0.500000 0.731217 0.983860 S\n0.500000 0.231217 0.016140 S\n0.500000 0.895395 0.738327 S\n",
"nsites": 16,
"nelements": 3,
"elements": [
"Ba",
"Hg",
"S"
],
"chemical_system": "Ba-Hg-S",
"density": 5.851582444239015,
"density_atomic": 0.035059635475583766,
"volume": 456.3652697171573,
"volume_molar": 17.17684932632554,
"formula_full": "Ba4 Hg4 S8",
"formula_reduced": "BaHgS2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.1638701425000001,
"spacegroup": 26
},
{
"id": "jvasp-88567",
"created_at": "2022-09-04T14:36:04.684938Z",
"updated_at": "2022-09-04T14:36:04.684957Z",
"structure_string": "Y8 Os2 Br8\n1.0\n6.584067 0.000463 0.078892\n0.104756 8.829815 0.090857\n0.000653 -0.003505 8.830903\nY Os Br\n8 2 8\ndirect\n0.009378 0.253383 0.900273 Y\n0.490438 0.252098 0.098499 Y\n0.990622 0.746617 0.099726 Y\n0.490621 0.099726 0.746617 Y\n0.990438 0.098499 0.252098 Y\n0.509562 0.747902 0.901500 Y\n0.009562 0.901500 0.747902 Y\n0.509379 0.900273 0.253382 Y\n0.250001 0.994647 0.005353 Os\n0.750000 0.005353 0.994647 Os\n0.093614 0.186642 0.577729 Br\n0.906387 0.813358 0.422271 Br\n0.593615 0.577728 0.186642 Br\n0.095734 0.417922 0.194849 Br\n0.404266 0.805151 0.582078 Br\n0.904266 0.582078 0.805151 Br\n0.595734 0.194848 0.417922 Br\n0.406386 0.422271 0.813358 Br\n",
"nsites": 18,
"nelements": 3,
"elements": [
"Y",
"Os",
"Br"
],
"chemical_system": "Br-Os-Y",
"density": 5.598592369099682,
"density_atomic": 0.03506069675555066,
"volume": 513.3953875902457,
"volume_molar": 17.17632938668454,
"formula_full": "Y8 Os2 Br8",
"formula_reduced": "Y4OsBr4",
"formula_anonymous": "AB4C4",
"energy_above_hull": 2.117554802222222,
"spacegroup": 15
},
{
"id": "jvasp-116269",
"created_at": "2022-09-04T14:38:41.533037Z",
"updated_at": "2022-09-04T14:38:41.533073Z",
"structure_string": "Li1 H1\n1.0\n4.145088 -0.000000 -0.000000\n0.000000 4.145088 -0.000000\n0.000000 0.000000 3.319989\nLi H\n1 1\ndirect\n0.000000 0.000000 -0.161271 Li\n0.000000 0.000000 0.338723 H\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Li",
"H"
],
"chemical_system": "H-Li",
"density": 0.23139510178677916,
"density_atomic": 0.03506112449247505,
"volume": 57.04323603281028,
"volume_molar": 17.176119839774376,
"formula_full": "Li1 H1",
"formula_reduced": "LiH",
"formula_anonymous": "AB",
"energy_above_hull": 1.0259,
"spacegroup": 123
},
{
"id": "jvasp-35418",
"created_at": "2022-09-04T14:37:38.067000Z",
"updated_at": "2022-09-04T14:37:38.067021Z",
"structure_string": "Rb2 Mg1 Cl4\n1.0\n4.967316 -0.000000 -0.000000\n-0.000000 4.967316 -0.000000\n-2.483657 -2.483657 8.091481\nRb Mg Cl\n2 1 4\ndirect\n0.356434 0.356434 0.712868 Rb\n0.643566 0.643566 0.287132 Rb\n0.000000 0.000000 0.000000 Mg\n0.156010 0.156010 0.312021 Cl\n0.843990 0.843990 0.687978 Cl\n0.000000 0.500000 0.000000 Cl\n0.500000 0.000000 0.000000 Cl\n",
"nsites": 7,
"nelements": 3,
"elements": [
"Rb",
"Mg",
"Cl"
],
"chemical_system": "Cl-Mg-Rb",
"density": 2.803336183470353,
"density_atomic": 0.03506117315281241,
"volume": 199.6510490248242,
"volume_molar": 17.176096001559312,
"formula_full": "Rb2 Mg1 Cl4",
"formula_reduced": "Rb2MgCl4",
"formula_anonymous": "AB2C4",
"energy_above_hull": 0.0,
"spacegroup": 139
},
{
"id": "jvasp-101038",
"created_at": "2022-09-04T14:36:47.013368Z",
"updated_at": "2022-09-04T14:36:47.013386Z",
"structure_string": "Yb1 Ce1 Mg2\n1.0\n4.714539 -0.000000 2.721940\n1.571513 4.444910 2.721940\n-0.000000 -0.000000 5.443880\nYb Ce Mg\n1 1 2\ndirect\n0.000000 0.000000 0.000000 Yb\n0.500000 0.500000 0.500000 Ce\n0.250000 0.250000 0.250000 Mg\n0.750000 0.750000 0.750000 Mg\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Yb",
"Ce",
"Mg"
],
"chemical_system": "Ce-Mg-Yb",
"density": 5.265821064383515,
"density_atomic": 0.03506301385718877,
"volume": 114.08032453490598,
"volume_molar": 17.175194307392132,
"formula_full": "Yb1 Ce1 Mg2",
"formula_reduced": "YbCeMg2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-100612",
"created_at": "2022-09-04T14:36:37.861937Z",
"updated_at": "2022-09-04T14:36:37.861967Z",
"structure_string": "Nd2 In1 Hg1\n1.0\n4.714515 0.000000 2.721926\n1.571505 4.444887 2.721926\n0.000000 0.000000 5.443853\nNd In Hg\n2 1 1\ndirect\n0.249999 0.250000 0.250000 Nd\n0.749998 0.750001 0.750001 Nd\n0.000000 0.000000 0.000000 In\n0.499999 0.500000 0.500001 Hg\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Nd",
"In",
"Hg"
],
"chemical_system": "Hg-In-Nd",
"density": 8.7903109450479,
"density_atomic": 0.03506354768968014,
"volume": 114.07858769457248,
"volume_molar": 17.17493281996798,
"formula_full": "Nd2 In1 Hg1",
"formula_reduced": "Nd2InHg",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.1644143925,
"spacegroup": 225
},
{
"id": "jvasp-40281",
"created_at": "2022-09-04T14:37:47.373263Z",
"updated_at": "2022-09-04T14:37:47.373283Z",
"structure_string": "Sr1 Mg1 Tl2\n1.0\n-0.000000 3.849278 3.849278\n3.849278 -0.000000 3.849278\n3.849278 3.849278 0.000000\nSr Mg Tl\n1 1 2\ndirect\n0.750001 0.750001 0.750001 Sr\n0.250001 0.250001 0.250001 Mg\n0.000000 0.000000 0.000000 Tl\n0.500000 0.500000 0.500000 Tl\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Sr",
"Mg",
"Tl"
],
"chemical_system": "Mg-Sr-Tl",
"density": 7.579871455851567,
"density_atomic": 0.03506647917163934,
"volume": 114.06905097090767,
"volume_molar": 17.173497032660517,
"formula_full": "Sr1 Mg1 Tl2",
"formula_reduced": "SrMgTl2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-37581",
"created_at": "2022-09-04T14:38:01.809771Z",
"updated_at": "2022-09-04T14:38:01.809794Z",
"structure_string": "Sr2 Br6\n1.0\n3.341315 -5.787328 -0.000000\n3.341315 5.787328 0.000000\n-0.000000 0.000000 5.898844\nSr Br\n2 6\ndirect\n0.333334 0.666668 0.250000 Sr\n0.666668 0.333334 0.749999 Sr\n0.171590 0.828411 0.749999 Br\n0.656821 0.828412 0.749999 Br\n0.171590 0.343180 0.749999 Br\n0.828411 0.171590 0.250000 Br\n0.343180 0.171590 0.250000 Br\n0.828412 0.656821 0.250000 Br\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Sr",
"Br"
],
"chemical_system": "Br-Sr",
"density": 4.765134167523925,
"density_atomic": 0.03506691518950952,
"volume": 228.13526529967618,
"volume_molar": 17.17328349943242,
"formula_full": "Sr2 Br6",
"formula_reduced": "SrBr3",
"formula_anonymous": "AB3",
"energy_above_hull": 0.1628860262499999,
"spacegroup": 194
},
{
"id": "jvasp-78711",
"created_at": "2022-09-04T14:37:16.545945Z",
"updated_at": "2022-09-04T14:37:16.545978Z",
"structure_string": "In1 Sb1\n1.0\n2.941536 0.198837 1.335515\n1.232312 4.288877 0.565458\n-0.265320 0.088871 4.489377\nIn Sb\n1 1\ndirect\n0.001326 0.500043 0.500043 In\n0.248674 -0.000042 -0.000043 Sb\n",
"nsites": 2,
"nelements": 2,
"elements": [
"In",
"Sb"
],
"chemical_system": "In-Sb",
"density": 6.888938800474678,
"density_atomic": 0.03507186564923264,
"volume": 57.025765894599886,
"volume_molar": 17.17085945820439,
"formula_full": "In1 Sb1",
"formula_reduced": "InSb",
"formula_anonymous": "AB",
"energy_above_hull": 0.370763035,
"spacegroup": 119
},
{
"id": "jvasp-89930",
"created_at": "2022-09-04T14:36:04.172095Z",
"updated_at": "2022-09-04T14:36:04.172121Z",
"structure_string": "Ba3 Zn2 As4\n1.0\n0.000000 4.510935 -0.000000\n0.033209 -0.000000 7.269698\n7.810163 -2.255468 -3.309590\nBa Zn As\n3 2 4\ndirect\n0.855537 0.415206 0.711076 Ba\n0.144461 0.584795 0.288924 Ba\n0.000000 0.000000 0.000000 Ba\n0.669917 0.963701 0.339836 Zn\n0.330081 0.036299 0.660163 Zn\n0.793622 0.832216 0.587246 As\n0.206376 0.167784 0.412754 As\n0.509783 0.680948 0.019565 As\n0.490216 0.319053 0.980434 As\n",
"nsites": 9,
"nelements": 3,
"elements": [
"Ba",
"Zn",
"As"
],
"chemical_system": "As-Ba-Zn",
"density": 5.451657494968196,
"density_atomic": 0.03507192402291807,
"volume": 256.6155194143004,
"volume_molar": 17.17083087903811,
"formula_full": "Ba3 Zn2 As4",
"formula_reduced": "Ba3(ZnAs2)2",
"formula_anonymous": "A2B3C4",
"energy_above_hull": 0.6056339677777776,
"spacegroup": 12
}
]
}