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=-elements&page=1075",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-elements&page=1073",
"results": [
{
"id": "jvasp-7939",
"created_at": "2022-09-04T14:37:04.830600Z",
"updated_at": "2022-09-04T14:37:04.830616Z",
"structure_string": "Tl2 In2 S4\n1.0\n1.945778 -3.370187 -0.000000\n1.945778 3.370187 -0.000000\n0.000000 0.000000 14.924193\nTl In S\n2 2 4\ndirect\n0.666668 0.333333 0.250000 Tl\n0.333333 0.666668 0.750000 Tl\n0.000000 0.000000 0.500000 In\n0.000000 0.000000 0.000000 In\n0.333333 0.666668 0.097376 S\n0.666668 0.333333 0.597375 S\n0.333333 0.666668 0.402624 S\n0.666668 0.333333 0.902624 S\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Tl",
"In",
"S"
],
"chemical_system": "In-S-Tl",
"density": 6.50407042344168,
"density_atomic": 0.040871619527499445,
"volume": 195.73484223245424,
"volume_molar": 14.734284644502901,
"formula_full": "Tl2 In2 S4",
"formula_reduced": "TlInS2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.5125306425,
"spacegroup": 194
},
{
"id": "jvasp-8539",
"created_at": "2022-09-04T14:37:05.148707Z",
"updated_at": "2022-09-04T14:37:05.148726Z",
"structure_string": "Tl1 In1 S2\n1.0\n3.754696 -0.016220 6.808763\n1.740353 3.327036 6.808763\n-0.026921 -0.016220 7.775362\nTl In S\n1 1 2\ndirect\n0.000000 0.000000 0.000000 Tl\n0.500000 0.500001 0.499999 In\n0.768380 0.768381 0.768378 S\n0.231620 0.231620 0.231620 S\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Tl",
"In",
"S"
],
"chemical_system": "In-S-Tl",
"density": 6.483056017213429,
"density_atomic": 0.04073956486633498,
"volume": 98.18465202374776,
"volume_molar": 14.782044873965695,
"formula_full": "Tl1 In1 S2",
"formula_reduced": "TlInS2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.5126331424999999,
"spacegroup": 166
},
{
"id": "jvasp-115148",
"created_at": "2022-09-04T14:38:43.412592Z",
"updated_at": "2022-09-04T14:38:43.412621Z",
"structure_string": "Tl1 In2 S2\n1.0\n-2.604436 2.604436 5.246828\n2.604436 -2.604436 5.246828\n2.604436 2.604436 -5.246828\nTl In S\n1 2 2\ndirect\n0.000000 0.000000 0.000000 Tl\n0.750000 0.250000 0.500000 In\n0.250000 0.750000 0.500000 In\n0.666063 0.666063 0.000000 S\n0.333937 0.333937 0.000000 S\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Tl",
"In",
"S"
],
"chemical_system": "In-S-Tl",
"density": 5.810646074517632,
"density_atomic": 0.03512253111605226,
"volume": 142.35876063370674,
"volume_molar": 17.146089899106578,
"formula_full": "Tl1 In2 S2",
"formula_reduced": "Tl(InS)2",
"formula_anonymous": "AB2C2",
"energy_above_hull": 0.4220305079999998,
"spacegroup": 139
},
{
"id": "jvasp-51358",
"created_at": "2022-09-04T14:37:06.235206Z",
"updated_at": "2022-09-04T14:37:06.235235Z",
"structure_string": "Tl1 In1 S2\n1.0\n4.032607 -0.035463 0.040563\n-1.265112 4.855219 -0.123716\n-1.212915 -1.190473 5.783104\nTl In S\n1 1 2\ndirect\n0.990179 0.749549 0.820200 Tl\n0.778819 0.268219 0.209195 In\n0.345908 0.197514 0.531888 S\n0.385100 0.784720 0.438713 S\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Tl",
"In",
"S"
],
"chemical_system": "In-S-Tl",
"density": 5.649578265200412,
"density_atomic": 0.03550198542037236,
"volume": 112.66975501895878,
"volume_molar": 16.962828102972157,
"formula_full": "Tl1 In1 S2",
"formula_reduced": "TlInS2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.6019281425,
"spacegroup": 1
},
{
"id": "jvasp-110654",
"created_at": "2022-09-04T14:38:36.505830Z",
"updated_at": "2022-09-04T14:38:36.505860Z",
"structure_string": "Tl1 In1 O2\n1.0\n3.252545 -0.004465 5.909891\n1.515397 2.877958 5.909891\n-0.007410 -0.004465 6.745799\nTl In O\n1 1 2\ndirect\n0.000000 0.000000 0.000000 Tl\n0.500000 0.499999 0.500001 In\n0.224462 0.224461 0.224462 O\n0.775538 0.775536 0.775539 O\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Tl",
"In",
"O"
],
"chemical_system": "In-O-Tl",
"density": 9.20381310634425,
"density_atomic": 0.06312829418248136,
"volume": 63.363030029568485,
"volume_molar": 9.53952714545421,
"formula_full": "Tl1 In1 O2",
"formula_reduced": "TlInO2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.5950148925,
"spacegroup": 166
},
{
"id": "jvasp-116001",
"created_at": "2022-09-04T14:38:40.630027Z",
"updated_at": "2022-09-04T14:38:40.630059Z",
"structure_string": "Tl1 In1 F2\n1.0\n3.629941 0.000000 -0.000000\n0.000000 3.629941 0.000000\n0.000000 0.000000 6.098976\nTl In F\n1 1 2\ndirect\n0.500000 0.500000 0.531627 Tl\n0.000000 0.000000 0.001266 In\n0.000000 0.000000 0.369580 F\n0.500000 0.500000 0.107527 F\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Tl",
"In",
"F"
],
"chemical_system": "F-In-Tl",
"density": 7.380778779236848,
"density_atomic": 0.04977415943249308,
"volume": 80.36298444025071,
"volume_molar": 12.098930104821989,
"formula_full": "Tl1 In1 F2",
"formula_reduced": "TlInF2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.0,
"spacegroup": 99
},
{
"id": "jvasp-116000",
"created_at": "2022-09-04T14:38:40.394221Z",
"updated_at": "2022-09-04T14:38:40.394241Z",
"structure_string": "Tl1 In1 F1\n1.0\n3.227714 0.000000 0.000000\n0.000000 3.227714 -0.000000\n0.000000 0.000000 7.916990\nTl In F\n1 1 1\ndirect\n0.000000 0.000000 0.013783 Tl\n0.000000 0.000000 0.580919 In\n0.000000 0.000000 0.311564 F\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Tl",
"In",
"F"
],
"chemical_system": "F-In-Tl",
"density": 6.8088243600209495,
"density_atomic": 0.03637232528505638,
"volume": 82.48029171873029,
"volume_molar": 16.556930888535206,
"formula_full": "Tl1 In1 F1",
"formula_reduced": "TlInF",
"formula_anonymous": "ABC",
"energy_above_hull": 0.0,
"spacegroup": 99
},
{
"id": "jvasp-108056",
"created_at": "2022-09-04T14:36:12.045378Z",
"updated_at": "2022-09-04T14:36:12.045405Z",
"structure_string": "Tl1 In1 F6\n1.0\n4.807522 0.158587 3.418798\n1.848995 4.440568 3.418798\n0.229528 0.158587 5.894724\nTl In F\n1 1 6\ndirect\n0.499999 0.500001 0.500000 Tl\n0.000000 0.000000 0.000000 In\n0.590141 0.922770 0.243235 F\n0.243234 0.590143 0.922768 F\n0.922768 0.243236 0.590142 F\n0.756764 0.409859 0.077232 F\n0.077230 0.756766 0.409858 F\n0.409857 0.077232 0.756765 F\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Tl",
"In",
"F"
],
"chemical_system": "F-In-Tl",
"density": 6.037261938680714,
"density_atomic": 0.06714300315700039,
"volume": 119.14867706011914,
"volume_molar": 8.969126307797755,
"formula_full": "Tl1 In1 F6",
"formula_reduced": "TlInF6",
"formula_anonymous": "ABC6",
"energy_above_hull": 0.0,
"spacegroup": 148
},
{
"id": "jvasp-36983",
"created_at": "2022-09-04T14:38:09.252402Z",
"updated_at": "2022-09-04T14:38:09.252411Z",
"structure_string": "Tl2 In2 Cl6\n1.0\n7.233009 0.439294 0.358927\n3.980282 6.899494 0.090874\n3.935862 2.253382 6.553850\nTl In Cl\n2 2 6\ndirect\n0.014212 -0.011854 -0.001841 Tl\n0.471793 0.501914 0.511798 Tl\n0.242985 0.244995 0.255009 In\n0.742999 0.744980 0.755017 In\n0.478713 0.069509 -0.113212 Cl\n0.007309 0.420502 0.623167 Cl\n0.481311 0.550862 0.079312 Cl\n0.004711 0.939073 0.430707 Cl\n0.480391 0.875960 0.562143 Cl\n0.005572 0.614056 -0.052103 Cl\n",
"nsites": 10,
"nelements": 3,
"elements": [
"Tl",
"In",
"Cl"
],
"chemical_system": "Cl-In-Tl",
"density": 4.592382176468907,
"density_atomic": 0.032493599496908235,
"volume": 307.7529161074168,
"volume_molar": 18.533313800993355,
"formula_full": "Tl2 In2 Cl6",
"formula_reduced": "TlInCl3",
"formula_anonymous": "ABC3",
"energy_above_hull": 0.0,
"spacegroup": 148
},
{
"id": "jvasp-92387",
"created_at": "2022-09-04T14:36:17.063448Z",
"updated_at": "2022-09-04T14:36:17.063474Z",
"structure_string": "Tl1 I1 O3\n1.0\n4.242230 -0.033181 0.032939\n0.032427 4.242231 0.032939\n-0.033698 -0.033181 4.242218\nTl I O\n1 1 3\ndirect\n0.000000 0.000000 0.000000 Tl\n0.500000 0.500000 0.500000 I\n0.500000 0.000000 0.500000 O\n0.500000 0.500000 0.000000 O\n0.000000 0.500000 0.500000 O\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Tl",
"I",
"O"
],
"chemical_system": "I-O-Tl",
"density": 8.248125147032654,
"density_atomic": 0.06548010549756389,
"volume": 76.35907062162597,
"volume_molar": 9.196901431724246,
"formula_full": "Tl1 I1 O3",
"formula_reduced": "TlIO3",
"formula_anonymous": "ABC3",
"energy_above_hull": 1.2490778749999998,
"spacegroup": 221
},
{
"id": "jvasp-3561",
"created_at": "2022-09-04T14:36:04.837352Z",
"updated_at": "2022-09-04T14:36:04.837375Z",
"structure_string": "Tl1 I1 O3\n1.0\n4.504994 0.021283 0.085218\n0.084023 4.504260 0.085218\n0.021581 0.021283 4.505748\nTl I O\n1 1 3\ndirect\n0.996730 0.996730 0.996733 Tl\n0.498070 0.498070 0.498072 I\n0.538255 0.090986 0.538256 O\n0.090986 0.538255 0.538256 O\n0.538255 0.538255 0.090987 O\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Tl",
"I",
"O"
],
"chemical_system": "I-O-Tl",
"density": 6.890438287122894,
"density_atomic": 0.05470171922980332,
"volume": 91.40480537722905,
"volume_molar": 11.009052082441563,
"formula_full": "Tl1 I1 O3",
"formula_reduced": "TlIO3",
"formula_anonymous": "ABC3",
"energy_above_hull": 1.2088358749999997,
"spacegroup": 160
},
{
"id": "jvasp-37358",
"created_at": "2022-09-04T14:38:02.141147Z",
"updated_at": "2022-09-04T14:38:02.141164Z",
"structure_string": "Tl4 I6 O18\n1.0\n7.114901 0.035064 0.001072\n-2.213423 -6.788189 0.021248\n-3.090743 0.388135 -10.122283\nTl I O\n4 6 18\ndirect\n0.000000 0.500000 -0.000000 Tl\n0.159376 0.464869 0.400418 Tl\n0.840625 0.535132 0.599582 Tl\n0.500000 0.000000 0.000000 Tl\n0.960850 0.024433 0.809408 I\n0.554091 0.468766 0.192518 I\n0.039151 0.975568 0.190592 I\n0.591433 0.950004 0.370948 I\n0.408568 0.049997 0.629051 I\n0.445910 0.531235 0.807482 I\n0.717488 0.650019 0.810528 O\n0.152871 0.951383 0.952575 O\n0.847130 0.048618 0.047424 O\n0.431677 0.667424 0.949650 O\n0.568324 0.332577 0.050350 O\n0.321507 0.665220 0.674468 O\n0.678494 0.334781 0.325531 O\n0.282513 0.349982 0.189472 O\n0.412585 0.302670 0.585471 O\n0.954685 0.047363 0.322914 O\n0.081568 0.292975 0.814875 O\n0.918433 0.707027 0.185125 O\n0.458827 0.874303 0.191069 O\n0.587416 0.697332 0.414529 O\n0.663873 0.061343 0.606614 O\n0.336128 0.938659 0.393385 O\n0.045316 0.952639 0.677086 O\n0.541174 0.125698 0.808930 O\n",
"nsites": 28,
"nelements": 3,
"elements": [
"Tl",
"I",
"O"
],
"chemical_system": "I-O-Tl",
"density": 6.352634800291711,
"density_atomic": 0.0573760065830098,
"volume": 488.00886760026566,
"volume_molar": 10.495921760060726,
"formula_full": "Tl4 I6 O18",
"formula_reduced": "Tl2(IO3)3",
"formula_anonymous": "A2B3C9",
"energy_above_hull": 1.6767232517857145,
"spacegroup": 2
}
]
}