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=-formula_reduced&page=517",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-formula_reduced&page=515",
"results": [
{
"id": "jvasp-115149",
"created_at": "2022-09-04T14:38:44.548672Z",
"updated_at": "2022-09-04T14:38:44.548698Z",
"structure_string": "Tl1 In1 S1\n1.0\n3.097364 0.000000 0.000000\n0.000000 3.097364 0.000000\n0.000000 0.000000 8.943239\nTl In S\n1 1 1\ndirect\n0.000000 0.000000 0.693159 Tl\n0.000000 0.000000 0.293587 In\n0.000000 0.000000 0.004411 S\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Tl",
"In",
"S"
],
"chemical_system": "In-S-Tl",
"density": 6.7983928023522,
"density_atomic": 0.03496567568111495,
"volume": 85.7984277884356,
"volume_molar": 17.223006970955154,
"formula_full": "Tl1 In1 S1",
"formula_reduced": "TlInS",
"formula_anonymous": "ABC",
"energy_above_hull": 0.2734808566666667,
"spacegroup": 99
},
{
"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-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-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-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-25668",
"created_at": "2022-09-04T14:38:15.320442Z",
"updated_at": "2022-09-04T14:38:15.320459Z",
"structure_string": "Tl4 In4 As8 O28\n1.0\n-7.902956 0.018936 -0.006348\n2.340456 8.342436 0.010934\n-0.009699 -0.250588 -10.567482\nTl In As O\n4 4 8 28\ndirect\n0.315597 0.943346 0.187657 Tl\n0.684404 0.056655 0.812343 Tl\n0.654253 0.539352 0.681530 Tl\n0.345747 0.460649 0.318470 Tl\n0.737215 0.261775 0.406515 In\n0.262785 0.738226 0.593486 In\n0.733531 0.772145 0.101307 In\n0.266470 0.227856 0.898693 In\n0.953288 0.203479 0.133184 As\n0.046713 0.796522 0.866816 As\n0.339386 0.145171 0.569357 As\n0.660615 0.854830 0.430643 As\n0.370155 0.667201 0.899296 As\n0.065759 0.327520 0.643946 As\n0.629846 0.332800 0.100705 As\n0.934241 0.672481 0.356054 As\n0.166842 0.262631 0.085030 O\n0.831544 0.029231 0.065394 O\n0.402193 0.482720 0.881393 O\n0.597808 0.517280 0.118607 O\n0.833158 0.737370 0.914970 O\n0.577022 0.219128 0.233207 O\n0.517165 0.218779 0.977680 O\n0.871107 0.818233 0.455657 O\n0.422979 0.780873 0.766794 O\n0.128893 0.181768 0.544343 O\n0.609946 0.837460 0.273215 O\n0.390054 0.162540 0.726786 O\n0.873251 0.348301 0.586283 O\n0.168456 0.970770 0.934606 O\n0.954155 0.222565 0.294482 O\n0.040900 0.251967 0.793117 O\n0.761642 0.507759 0.366641 O\n0.310142 0.961167 0.500353 O\n0.510520 0.710669 0.509518 O\n0.141592 0.645083 0.929144 O\n0.858408 0.354917 0.070856 O\n0.126749 0.651700 0.413717 O\n0.489480 0.289332 0.490483 O\n0.959101 0.748034 0.206883 O\n0.045845 0.777435 0.705518 O\n0.482836 0.781222 0.022321 O\n0.689858 0.038834 0.499647 O\n0.238358 0.492242 0.633360 O\n",
"nsites": 44,
"nelements": 4,
"elements": [
"Tl",
"In",
"As",
"O"
],
"chemical_system": "As-In-O-Tl",
"density": 5.535808150136364,
"density_atomic": 0.0631129329638526,
"volume": 697.1629733195988,
"volume_molar": 9.541848995433519,
"formula_full": "Tl4 In4 As8 O28",
"formula_reduced": "TlInAs2O7",
"formula_anonymous": "ABC2D7",
"energy_above_hull": 2.118473688181818,
"spacegroup": 2
},
{
"id": "jvasp-55108",
"created_at": "2022-09-04T14:38:36.044017Z",
"updated_at": "2022-09-04T14:38:36.044031Z",
"structure_string": "Tl2 In10 Se14\n1.0\n0.000000 9.591629 -0.008749\n4.124665 0.000000 0.000000\n0.000000 -3.432614 -17.709581\nTl In Se\n2 10 14\ndirect\n0.022629 0.749999 0.727802 Tl\n0.977372 0.250000 0.272198 Tl\n0.852215 0.749999 0.047084 In\n0.483420 0.749999 0.397256 In\n0.566792 0.250000 0.123303 In\n0.147786 0.250000 0.952916 In\n0.516580 0.250000 0.602744 In\n0.679731 0.749999 0.813173 In\n0.171034 0.749999 0.533920 In\n0.320270 0.250000 0.186827 In\n0.828967 0.250000 0.466080 In\n0.433209 0.749999 0.876697 In\n0.257538 0.250000 0.821411 Se\n0.056317 0.250000 0.091699 Se\n0.029449 0.250000 0.591640 Se\n0.378742 0.749999 0.657487 Se\n0.738885 0.250000 0.727114 Se\n0.336604 0.749999 0.006845 Se\n0.261115 0.749999 0.272886 Se\n0.329544 0.250000 0.466413 Se\n0.663396 0.250000 0.993156 Se\n0.670457 0.749999 0.533587 Se\n0.621259 0.250000 0.342513 Se\n0.970551 0.749999 0.408360 Se\n0.943683 0.749999 0.908301 Se\n0.742462 0.749999 0.178589 Se\n",
"nsites": 26,
"nelements": 3,
"elements": [
"Tl",
"In",
"Se"
],
"chemical_system": "In-Se-Tl",
"density": 6.308906629590986,
"density_atomic": 0.037102846680261106,
"volume": 700.7548564685234,
"volume_molar": 16.23093993810402,
"formula_full": "Tl2 In10 Se14",
"formula_reduced": "TlIn5Se7",
"formula_anonymous": "AB5C7",
"energy_above_hull": 0.5876504628205128,
"spacegroup": 11
},
{
"id": "jvasp-57275",
"created_at": "2022-09-04T14:38:34.319272Z",
"updated_at": "2022-09-04T14:38:34.319303Z",
"structure_string": "Tl2 In10 S14\n1.0\n0.000000 9.220332 -0.011768\n3.941399 0.000000 0.000000\n0.000000 -3.720690 -17.114957\nTl In S\n2 10 14\ndirect\n0.974213 0.250000 0.274780 Tl\n0.025787 0.750000 0.725221 Tl\n0.565864 0.250000 0.119583 In\n0.476509 0.750000 0.397466 In\n0.827652 0.250000 0.467548 In\n0.319705 0.250000 0.188858 In\n0.680295 0.750000 0.811143 In\n0.434136 0.750000 0.880417 In\n0.854883 0.750000 0.045853 In\n0.523491 0.250000 0.602534 In\n0.145117 0.250000 0.954148 In\n0.172348 0.750000 0.532453 In\n0.739684 0.250000 0.728119 S\n0.335718 0.750000 0.006670 S\n0.614995 0.250000 0.347203 S\n0.385005 0.750000 0.652797 S\n0.035785 0.250000 0.588909 S\n0.742895 0.750000 0.172456 S\n0.964215 0.750000 0.411091 S\n0.669641 0.750000 0.532994 S\n0.056912 0.250000 0.090154 S\n0.664282 0.250000 0.993331 S\n0.330359 0.250000 0.467007 S\n0.257105 0.250000 0.827544 S\n0.260316 0.750000 0.271881 S\n0.943088 0.750000 0.909846 S\n",
"nsites": 26,
"nelements": 3,
"elements": [
"Tl",
"In",
"S"
],
"chemical_system": "In-S-Tl",
"density": 5.353720842346675,
"density_atomic": 0.04179074283530434,
"volume": 622.1473521651666,
"volume_molar": 14.410226646922785,
"formula_full": "Tl2 In10 S14",
"formula_reduced": "TlIn5S7",
"formula_anonymous": "AB5C7",
"energy_above_hull": 0.912985573076923,
"spacegroup": 11
},
{
"id": "jvasp-26915",
"created_at": "2022-09-04T14:38:35.624349Z",
"updated_at": "2022-09-04T14:38:35.624364Z",
"structure_string": "Tl2 In10 S12\n1.0\n0.000000 8.897689 -0.007781\n3.970540 0.000000 0.000000\n0.000000 -1.519241 -17.608886\nTl In S\n2 10 12\ndirect\n0.379542 0.750000 0.783626 Tl\n0.620458 0.250000 0.216374 Tl\n0.303456 0.750000 0.994910 In\n0.889648 0.250000 0.886918 In\n0.110353 0.750000 0.113082 In\n0.965913 0.250000 0.382882 In\n0.696544 0.250000 0.005090 In\n0.232191 0.250000 0.313291 In\n0.767810 0.750000 0.686709 In\n0.343125 0.250000 0.544953 In\n0.656875 0.750000 0.455047 In\n0.034088 0.750000 0.617119 In\n0.466578 0.250000 0.412128 S\n0.533423 0.750000 0.587873 S\n0.406757 0.250000 0.924705 S\n0.593243 0.750000 0.075295 S\n0.692597 0.250000 0.766861 S\n0.836889 0.250000 0.506217 S\n0.163111 0.750000 0.493783 S\n0.202115 0.250000 0.669374 S\n0.797885 0.750000 0.330626 S\n0.056154 0.750000 0.866890 S\n0.307404 0.750000 0.233139 S\n0.943846 0.250000 0.133110 S\n",
"nsites": 24,
"nelements": 3,
"elements": [
"Tl",
"In",
"S"
],
"chemical_system": "In-S-Tl",
"density": 5.182576632751412,
"density_atomic": 0.03857623126885287,
"volume": 622.1447562550783,
"volume_molar": 15.611013730266551,
"formula_full": "Tl2 In10 S12",
"formula_reduced": "TlIn5S6",
"formula_anonymous": "AB5C6",
"energy_above_hull": 0.7915785375,
"spacegroup": 11
},
{
"id": "jvasp-110527",
"created_at": "2022-09-04T14:38:39.434640Z",
"updated_at": "2022-09-04T14:38:39.434652Z",
"structure_string": "Tl1 In3\n1.0\n3.345444 0.000000 -0.000000\n0.000000 3.345444 -0.000000\n-0.000000 -0.000000 10.128128\nTl In\n1 3\ndirect\n0.000000 0.000000 0.000000 Tl\n0.499999 0.499999 0.742427 In\n0.000000 0.000000 0.500000 In\n0.499999 0.499999 0.257573 In\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Tl",
"In"
],
"chemical_system": "In-Tl",
"density": 8.039999212107853,
"density_atomic": 0.035287694172633534,
"volume": 113.35396357810473,
"volume_molar": 17.065838109281497,
"formula_full": "Tl1 In3",
"formula_reduced": "TlIn3",
"formula_anonymous": "AB3",
"energy_above_hull": 0.0014675,
"spacegroup": 123
},
{
"id": "jvasp-101039",
"created_at": "2022-09-04T14:36:48.716115Z",
"updated_at": "2022-09-04T14:36:48.716140Z",
"structure_string": "Tl2 In6\n1.0\n6.908914 0.000000 0.000000\n-3.454457 5.983295 0.000000\n0.000000 0.000000 5.545232\nTl In\n2 6\ndirect\n0.333333 0.666666 0.750000 Tl\n0.666666 0.333333 0.250000 Tl\n0.163989 0.327978 0.250000 In\n0.672020 0.836010 0.250000 In\n0.163989 0.836010 0.250000 In\n0.836010 0.672021 0.750000 In\n0.327978 0.163989 0.750000 In\n0.836010 0.163989 0.750000 In\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Tl",
"In"
],
"chemical_system": "In-Tl",
"density": 7.9515682138955786,
"density_atomic": 0.034899569007696196,
"volume": 229.22919186296562,
"volume_molar": 17.25563074624782,
"formula_full": "Tl2 In6",
"formula_reduced": "TlIn3",
"formula_anonymous": "AB3",
"energy_above_hull": 0.0,
"spacegroup": 194
}
]
}