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=1138",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-elements&page=1136",
"results": [
{
"id": "jvasp-40834",
"created_at": "2022-09-04T14:37:45.680827Z",
"updated_at": "2022-09-04T14:37:45.680847Z",
"structure_string": "Ti1 Bi1 Rh1\n1.0\n3.883804 -0.000000 2.242316\n1.294601 3.661686 2.242316\n-0.000000 -0.000000 4.484631\nTi Bi Rh\n1 1 1\ndirect\n0.250000 0.250000 0.250000 Ti\n0.000000 0.000000 0.000000 Bi\n0.499999 0.500001 0.500001 Rh\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Ti",
"Bi",
"Rh"
],
"chemical_system": "Bi-Rh-Ti",
"density": 9.36673604684048,
"density_atomic": 0.04703878936514423,
"volume": 63.777151591044166,
"volume_molar": 12.802499471770863,
"formula_full": "Ti1 Bi1 Rh1",
"formula_reduced": "TiBiRh",
"formula_anonymous": "ABC",
"energy_above_hull": 2.2410452111111114,
"spacegroup": 216
},
{
"id": "jvasp-50044",
"created_at": "2022-09-04T14:37:37.300809Z",
"updated_at": "2022-09-04T14:37:37.300826Z",
"structure_string": "Ti2 Bi4 O10\n1.0\n0.000000 4.018153 0.000000\n-6.186986 2.009076 -0.000000\n-0.000000 0.000000 10.351985\nTi Bi O\n2 4 10\ndirect\n0.162400 0.675202 0.250000 Ti\n0.837600 0.324799 0.750000 Ti\n0.141779 0.716442 0.924425 Bi\n0.141779 0.716442 0.575576 Bi\n0.858221 0.283558 0.075576 Bi\n0.858221 0.283558 0.424424 Bi\n0.061292 0.877418 0.381473 O\n0.061292 0.877418 0.118527 O\n0.724721 0.550559 0.914369 O\n0.724721 0.550559 0.585632 O\n0.295536 0.408930 0.750000 O\n0.704464 0.591071 0.250000 O\n0.275279 0.449442 0.085632 O\n0.275279 0.449442 0.414369 O\n0.938708 0.122583 0.618527 O\n0.938708 0.122583 0.881474 O\n",
"nsites": 16,
"nelements": 3,
"elements": [
"Ti",
"Bi",
"O"
],
"chemical_system": "Bi-O-Ti",
"density": 7.043736818620169,
"density_atomic": 0.06217141414282991,
"volume": 257.3530009023487,
"volume_molar": 9.686349977764692,
"formula_full": "Ti2 Bi4 O10",
"formula_reduced": "TiBi2O5",
"formula_anonymous": "AB2C5",
"energy_above_hull": 2.3256293041666667,
"spacegroup": 63
},
{
"id": "jvasp-11508",
"created_at": "2022-09-04T14:37:07.715536Z",
"updated_at": "2022-09-04T14:37:07.715563Z",
"structure_string": "Ti2 Bi4 O12\n1.0\n5.358142 -0.000000 0.000000\n0.000000 5.358142 -0.000000\n-0.000000 -0.000000 9.402891\nTi Bi O\n2 4 12\ndirect\n0.500000 0.500000 0.296801 Ti\n0.000000 0.000000 0.796806 Ti\n0.000000 0.500000 0.998754 Bi\n0.000000 0.500000 0.498749 Bi\n0.500000 0.000000 0.998754 Bi\n0.500000 0.000000 0.498749 Bi\n0.741272 0.741272 0.366379 O\n0.241271 0.758729 0.866391 O\n0.258727 0.741272 0.366379 O\n0.000000 0.000000 0.078027 O\n0.241271 0.241271 0.866391 O\n0.758729 0.241271 0.866391 O\n0.758729 0.758729 0.866391 O\n0.000000 0.000000 0.606375 O\n0.500000 0.500000 0.106372 O\n0.500000 0.500000 0.578020 O\n0.741272 0.258727 0.366379 O\n0.258727 0.258727 0.366379 O\n",
"nsites": 18,
"nelements": 3,
"elements": [
"Ti",
"Bi",
"O"
],
"chemical_system": "Bi-O-Ti",
"density": 6.911776646603542,
"density_atomic": 0.06667801546056651,
"volume": 269.95404520767767,
"volume_molar": 9.031673660955768,
"formula_full": "Ti2 Bi4 O12",
"formula_reduced": "Ti(BiO3)2",
"formula_anonymous": "AB2C6",
"energy_above_hull": 2.4713275481481487,
"spacegroup": 107
},
{
"id": "jvasp-98535",
"created_at": "2022-09-04T14:35:53.432469Z",
"updated_at": "2022-09-04T14:35:53.432495Z",
"structure_string": "Ti6 Bi8 O24\n1.0\n5.345229 -0.000000 -0.881230\n0.000081 5.459604 0.000492\n0.030972 0.012257 16.839621\nTi Bi O\n6 8 24\ndirect\n0.005336 0.481418 0.003287 Ti\n0.132146 0.471478 0.257647 Ti\n0.369667 0.976898 0.741262 Ti\n0.871594 0.476899 0.741262 Ti\n0.625500 0.971478 0.257647 Ti\n0.497951 0.981418 0.003287 Ti\n0.929403 0.019143 0.866390 Bi\n0.569601 0.515255 0.132598 Bi\n0.285835 0.520299 0.575033 Bi\n0.062996 0.015255 0.132598 Bi\n0.201850 0.026720 0.419464 Bi\n0.789198 0.020299 0.575033 Bi\n0.717614 0.526719 0.419464 Bi\n0.436987 0.519143 0.866390 Bi\n0.198731 0.159502 0.987609 O\n0.500209 0.760716 0.498491 O\n0.827146 0.235537 0.222609 O\n0.000773 0.757181 0.499190 O\n0.288878 0.659502 0.987609 O\n0.127062 0.468132 0.363422 O\n0.160394 0.234664 0.777816 O\n0.498281 0.260717 0.498491 O\n0.431395 0.652333 0.252420 O\n0.586780 0.674794 0.754076 O\n0.861053 0.478033 0.636202 O\n0.998417 0.257181 0.499190 O\n0.736360 0.968132 0.363422 O\n0.511201 0.938648 0.887308 O\n0.895464 0.735537 0.222609 O\n0.136702 0.433909 0.120547 O\n0.876107 0.438649 0.887308 O\n0.667296 0.174794 0.754076 O\n0.483844 0.933908 0.120547 O\n0.321025 0.152333 0.252420 O\n0.275149 0.978032 0.636202 O\n0.724869 0.237637 0.023427 O\n0.117421 0.734664 0.777816 O\n0.798557 0.737636 0.023427 O\n",
"nsites": 38,
"nelements": 3,
"elements": [
"Ti",
"Bi",
"O"
],
"chemical_system": "Bi-O-Ti",
"density": 7.914722358251819,
"density_atomic": 0.07730225915506353,
"volume": 491.57683637388084,
"volume_molar": 7.790381323681575,
"formula_full": "Ti6 Bi8 O24",
"formula_reduced": "Ti3(BiO3)4",
"formula_anonymous": "A3B4C12",
"energy_above_hull": 2.799017589473684,
"spacegroup": 9
},
{
"id": "jvasp-57504",
"created_at": "2022-09-04T14:36:50.726977Z",
"updated_at": "2022-09-04T14:36:50.726996Z",
"structure_string": "Ti4 Bi4 O14\n1.0\n6.366262 0.000000 3.675562\n2.122087 6.002169 3.675562\n0.000000 0.000000 7.351126\nTi Bi O\n4 4 14\ndirect\n-0.000000 -0.000000 0.500000 Ti\n0.000000 0.500000 -0.000000 Ti\n0.000000 0.000000 0.000000 Ti\n0.500000 -0.000000 -0.000000 Ti\n0.500000 0.500000 0.500000 Bi\n0.500000 0.500000 -0.000000 Bi\n0.000000 0.500000 0.500000 Bi\n0.500000 -0.000000 0.500000 Bi\n0.926386 0.323614 0.926386 O\n0.323614 0.926386 0.926386 O\n0.073614 0.676386 0.073613 O\n0.926386 0.926386 0.323613 O\n0.926386 0.323614 0.323614 O\n0.676386 0.073614 0.073614 O\n0.375000 0.375000 0.375000 O\n0.676386 0.073614 0.676386 O\n0.323614 0.323614 0.926386 O\n0.323614 0.926386 0.323613 O\n0.073614 0.676386 0.676386 O\n0.676386 0.676386 0.073613 O\n0.073614 0.073614 0.676386 O\n0.625000 0.625000 0.625000 O\n",
"nsites": 22,
"nelements": 3,
"elements": [
"Ti",
"Bi",
"O"
],
"chemical_system": "Bi-O-Ti",
"density": 7.397621887578424,
"density_atomic": 0.07832061460219232,
"volume": 280.8966721180988,
"volume_molar": 7.689087720503449,
"formula_full": "Ti4 Bi4 O14",
"formula_reduced": "Ti2Bi2O7",
"formula_anonymous": "A2B2C7",
"energy_above_hull": 2.6781990696969697,
"spacegroup": 227
},
{
"id": "jvasp-16908",
"created_at": "2022-09-04T14:36:48.186646Z",
"updated_at": "2022-09-04T14:36:48.186666Z",
"structure_string": "Ti1 Bi2 O6\n1.0\n3.781352 -0.011249 -0.342206\n0.001877 3.745205 -0.005738\n-0.774394 0.004761 8.838001\nTi Bi O\n1 2 6\ndirect\n0.469163 0.496352 0.205409 Ti\n0.068989 0.011108 0.540072 Bi\n0.807822 0.995841 0.945971 Bi\n0.556575 0.495228 0.408250 O\n0.628597 0.005725 0.679031 O\n-0.042299 0.495803 0.151671 O\n0.108929 0.508826 0.684483 O\n0.436304 0.495036 0.915055 O\n0.465927 -0.003917 0.140936 O\n",
"nsites": 9,
"nelements": 3,
"elements": [
"Ti",
"Bi",
"O"
],
"chemical_system": "Bi-O-Ti",
"density": 7.513277827197384,
"density_atomic": 0.07248070658758575,
"volume": 124.17097492177994,
"volume_molar": 8.308612103170987,
"formula_full": "Ti1 Bi2 O6",
"formula_reduced": "Ti(BiO3)2",
"formula_anonymous": "AB2C6",
"energy_above_hull": 2.46250865925926,
"spacegroup": 1
},
{
"id": "jvasp-52543",
"created_at": "2022-09-04T14:38:13.403645Z",
"updated_at": "2022-09-04T14:38:13.403676Z",
"structure_string": "Ti2 Bi4 O10\n1.0\n0.000000 5.630243 0.000000\n-7.910049 2.815121 -0.000872\n-0.000652 0.000000 5.527545\nTi Bi O\n2 4 10\ndirect\n0.314167 0.996631 0.736213 Ti\n0.689201 0.996631 0.236213 Ti\n0.956745 0.657375 0.756199 Bi\n0.385880 0.657376 0.256199 Bi\n0.617496 0.335885 0.756200 Bi\n0.046619 0.335885 0.256200 Bi\n0.254165 0.805489 0.658882 O\n0.940344 0.805489 0.158882 O\n0.242995 0.491559 0.485196 O\n0.265446 0.491559 0.985195 O\n0.760374 0.501699 0.985198 O\n0.737927 0.501699 0.485199 O\n0.063022 0.187770 0.658882 O\n0.749208 0.187770 0.158883 O\n0.599350 0.996633 0.563417 O\n0.404017 0.996633 0.063417 O\n",
"nsites": 16,
"nelements": 3,
"elements": [
"Ti",
"Bi",
"O"
],
"chemical_system": "Bi-O-Ti",
"density": 7.363660407773832,
"density_atomic": 0.06499521384851359,
"volume": 246.17197255926735,
"volume_molar": 9.265514186992284,
"formula_full": "Ti2 Bi4 O10",
"formula_reduced": "TiBi2O5",
"formula_anonymous": "AB2C5",
"energy_above_hull": 2.3123680541666665,
"spacegroup": 36
},
{
"id": "jvasp-12971",
"created_at": "2022-09-04T14:37:13.931179Z",
"updated_at": "2022-09-04T14:37:13.931198Z",
"structure_string": "Ti4 Bi2 O11\n1.0\n3.686774 0.000000 0.936577\n1.733718 7.389252 0.899995\n-0.009414 -0.000169 7.761718\nTi Bi O\n4 2 11\ndirect\n0.337513 0.107319 0.217655 Ti\n0.662488 0.892681 0.782345 Ti\n0.381052 0.705273 0.532624 Ti\n0.618949 0.294726 0.467376 Ti\n0.891523 0.358084 0.858871 Bi\n0.108478 0.641916 0.141129 Bi\n0.499999 -0.000000 0.000000 O\n0.855348 0.719488 0.569816 O\n0.708212 0.633717 0.949858 O\n0.799572 0.161301 0.239553 O\n0.563483 0.541625 0.331411 O\n0.436518 0.458375 0.668589 O\n0.375256 0.895545 0.353942 O\n0.624745 0.104455 0.646057 O\n0.291789 0.366282 0.050142 O\n0.200429 0.838698 0.760446 O\n0.144653 0.280512 0.430183 O\n",
"nsites": 17,
"nelements": 3,
"elements": [
"Ti",
"Bi",
"O"
],
"chemical_system": "Bi-O-Ti",
"density": 6.166135102976053,
"density_atomic": 0.08037290903137616,
"volume": 211.51405622712375,
"volume_molar": 7.492749525401727,
"formula_full": "Ti4 Bi2 O11",
"formula_reduced": "Ti4Bi2O11",
"formula_anonymous": "A2B4C11",
"energy_above_hull": 3.054733554901961,
"spacegroup": 12
},
{
"id": "jvasp-8322",
"created_at": "2022-09-04T14:37:05.519424Z",
"updated_at": "2022-09-04T14:37:05.519442Z",
"structure_string": "Ti1 Bi2 O6\n1.0\n5.364388 -0.000000 -0.000000\n0.000000 5.364388 -0.000000\n-0.000000 0.000000 4.651859\nTi Bi O\n1 2 6\ndirect\n0.500000 0.500000 0.594650 Ti\n0.500000 0.000000 0.996077 Bi\n0.000000 0.500000 0.996077 Bi\n0.741330 0.741330 0.730494 O\n0.258671 0.741330 0.730494 O\n0.000000 0.000000 0.177809 O\n0.500000 0.500000 0.207500 O\n0.258671 0.258671 0.730494 O\n0.741330 0.258671 0.730494 O\n",
"nsites": 9,
"nelements": 3,
"elements": [
"Ti",
"Bi",
"O"
],
"chemical_system": "Bi-O-Ti",
"density": 6.969195255046566,
"density_atomic": 0.06723193365804898,
"volume": 133.86495836599403,
"volume_molar": 8.957262467906173,
"formula_full": "Ti1 Bi2 O6",
"formula_reduced": "Ti(BiO3)2",
"formula_anonymous": "AB2C6",
"energy_above_hull": 2.472165325925926,
"spacegroup": 99
},
{
"id": "jvasp-97363",
"created_at": "2022-09-04T14:35:46.763359Z",
"updated_at": "2022-09-04T14:35:46.763385Z",
"structure_string": "Ti6 Bi8 O24\n1.0\n5.450845 0.000000 0.000000\n0.000000 5.406039 -0.899317\n0.000000 0.006005 16.734348\nTi Bi O\n6 8 24\ndirect\n0.003678 0.327545 0.743569 Ti\n0.503677 0.083977 0.256431 Ti\n0.496322 0.827545 0.743569 Ti\n0.996322 0.583977 0.256431 Ti\n0.500000 0.965112 -0.000000 Ti\n0.000000 0.465112 -0.000000 Ti\n0.503198 0.434088 0.867752 Bi\n0.980415 0.796869 0.577840 Bi\n0.480415 0.719029 0.422160 Bi\n0.519584 0.296869 0.577840 Bi\n0.003199 0.066337 0.132248 Bi\n0.996801 0.934088 0.867752 Bi\n0.019584 0.219029 0.422160 Bi\n0.496801 0.566337 0.132248 Bi\n0.245816 -0.005741 0.502160 O\n0.924298 0.475800 0.117168 O\n0.075701 0.358632 0.882832 O\n0.254183 0.494259 0.502159 O\n0.745816 -0.007901 0.497841 O\n0.698559 0.765473 0.249766 O\n0.747908 0.675713 0.979670 O\n0.301440 0.515707 0.750234 O\n0.801440 0.265473 0.249766 O\n0.198559 0.015706 0.750234 O\n0.221071 0.825562 0.220392 O\n0.778929 0.605170 0.779608 O\n0.278929 0.325562 0.220392 O\n0.721070 0.105170 0.779608 O\n0.442906 0.135389 0.362001 O\n0.557093 0.773388 0.637999 O\n0.057093 0.635389 0.362001 O\n0.942906 0.273388 0.637999 O\n0.575701 0.975800 0.117168 O\n0.424298 0.858632 0.882832 O\n0.752090 0.175713 0.979670 O\n0.247909 0.196044 0.020330 O\n0.252091 0.696044 0.020330 O\n0.754183 0.492100 0.497840 O\n",
"nsites": 38,
"nelements": 3,
"elements": [
"Ti",
"Bi",
"O"
],
"chemical_system": "Bi-O-Ti",
"density": 7.889497945797418,
"density_atomic": 0.07705589497697567,
"volume": 493.1485126654413,
"volume_molar": 7.815288839094553,
"formula_full": "Ti6 Bi8 O24",
"formula_reduced": "Ti3(BiO3)4",
"formula_anonymous": "A3B4C12",
"energy_above_hull": 2.7989649578947366,
"spacegroup": 41
},
{
"id": "jvasp-30537",
"created_at": "2022-09-04T14:37:28.843990Z",
"updated_at": "2022-09-04T14:37:28.844017Z",
"structure_string": "Ti1 Bi2 O6\n1.0\n3.747623 0.469436 -0.125970\n0.486062 3.745249 -0.131911\n-0.301275 -0.283851 9.128252\nTi Bi O\n1 2 6\ndirect\n0.466249 0.466242 0.796332 Ti\n0.031102 0.031159 0.472126 Bi\n0.151320 0.151258 0.097437 Bi\n0.435248 0.435242 0.595535 O\n0.993075 0.497599 0.321448 O\n0.458524 0.968668 0.835637 O\n0.497600 0.993104 0.321437 O\n0.498218 0.498176 0.053524 O\n0.968651 0.458559 0.835641 O\n",
"nsites": 9,
"nelements": 3,
"elements": [
"Ti",
"Bi",
"O"
],
"chemical_system": "Bi-O-Ti",
"density": 7.4164054043335526,
"density_atomic": 0.07154617683645567,
"volume": 125.79288507019338,
"volume_molar": 8.417138449991189,
"formula_full": "Ti1 Bi2 O6",
"formula_reduced": "Ti(BiO3)2",
"formula_anonymous": "AB2C6",
"energy_above_hull": 2.4625931037037043,
"spacegroup": 8
},
{
"id": "jvasp-67780",
"created_at": "2022-09-04T14:35:45.346401Z",
"updated_at": "2022-09-04T14:35:45.346427Z",
"structure_string": "Ti1 Be1 Zn2\n1.0\n-2.113892 2.113892 2.989045\n2.113892 -2.113892 2.989045\n2.113892 2.113892 -2.989045\nTi Be Zn\n1 1 2\ndirect\n0.749999 0.250000 0.500000 Ti\n0.499999 0.499999 0.000000 Be\n0.000000 0.000000 0.000000 Zn\n0.250000 0.749999 0.500000 Zn\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ti",
"Be",
"Zn"
],
"chemical_system": "Be-Ti-Zn",
"density": 5.833763444589651,
"density_atomic": 0.07486898686843817,
"volume": 53.42666125600056,
"volume_molar": 8.043571860511843,
"formula_full": "Ti1 Be1 Zn2",
"formula_reduced": "TiBeZn2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.6255763083333333,
"spacegroup": 216
}
]
}