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_anonymous&page=100",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=formula_anonymous&page=98",
"results": [
{
"id": "jvasp-109205",
"created_at": "2022-09-04T14:38:11.792830Z",
"updated_at": "2022-09-04T14:38:11.792856Z",
"structure_string": "Ba2 In2 O5\n1.0\n4.153191 -0.000000 0.000000\n0.000000 4.272954 0.000000\n-0.000000 -0.000000 8.737383\nBa In O\n2 2 5\ndirect\n-0.000000 0.991977 0.718219 Ba\n-0.000000 0.991977 0.281781 Ba\n0.500000 0.483185 0.500000 In\n0.500000 0.561479 -0.000000 In\n0.500000 0.437221 0.772242 O\n0.500000 0.437221 0.227757 O\n0.500000 0.983236 0.500000 O\n-0.000000 0.499487 0.500000 O\n-0.000000 0.758410 -0.000000 O\n",
"nsites": 9,
"nelements": 3,
"elements": [
"Ba",
"In",
"O"
],
"chemical_system": "Ba-In-O",
"density": 6.2572545983343675,
"density_atomic": 0.05804315546608781,
"volume": 155.05704208756057,
"volume_molar": 10.375281480894822,
"formula_full": "Ba2 In2 O5",
"formula_reduced": "Ba2In2O5",
"formula_anonymous": "A2B2C5",
"energy_above_hull": 1.1462432644444445,
"spacegroup": 25
},
{
"id": "jvasp-90120",
"created_at": "2022-09-04T14:36:04.240772Z",
"updated_at": "2022-09-04T14:36:04.240791Z",
"structure_string": "Sm2 Fe2 O5\n1.0\n7.135911 -0.020068 0.004384\n0.010686 3.895643 0.002693\n-0.002246 -0.002855 3.833283\nSm Fe O\n2 2 5\ndirect\n-0.000009 0.984634 0.000032 Sm\n0.499976 0.111897 0.999911 Sm\n0.206100 0.495173 0.500007 Fe\n0.793904 0.495128 0.500005 Fe\n0.216656 0.483339 0.000006 O\n0.783369 0.483257 0.000002 O\n0.500006 0.462438 0.499940 O\n0.218110 0.992080 0.500035 O\n0.781887 0.992041 0.500042 O\n",
"nsites": 9,
"nelements": 3,
"elements": [
"Sm",
"Fe",
"O"
],
"chemical_system": "Fe-O-Sm",
"density": 7.673087075607529,
"density_atomic": 0.08445771364767875,
"volume": 106.5622026845781,
"volume_molar": 7.130362047357546,
"formula_full": "Sm2 Fe2 O5",
"formula_reduced": "Sm2Fe2O5",
"formula_anonymous": "A2B2C5",
"energy_above_hull": 2.6195395833333333,
"spacegroup": 25
},
{
"id": "jvasp-89918",
"created_at": "2022-09-04T14:35:57.548632Z",
"updated_at": "2022-09-04T14:35:57.548649Z",
"structure_string": "V2 H2 O5\n1.0\n-0.000000 2.883415 0.000000\n0.126411 0.000000 4.861144\n5.986034 -1.441708 -0.737470\nV H O\n2 2 5\ndirect\n0.861873 0.600577 0.723744 V\n0.138127 0.399422 0.276255 V\n0.648186 0.936646 0.296371 H\n0.351814 0.063353 0.703629 H\n-0.000000 0.500000 -0.000000 O\n0.692096 0.649613 0.384191 O\n0.307904 0.350386 0.615808 O\n0.379426 0.869871 0.758851 O\n0.620574 0.130128 0.241148 O\n",
"nsites": 9,
"nelements": 3,
"elements": [
"V",
"H",
"O"
],
"chemical_system": "H-O-V",
"density": 3.627831886406459,
"density_atomic": 0.10692236744507488,
"volume": 84.17322039397625,
"volume_molar": 5.6322553492780845,
"formula_full": "V2 H2 O5",
"formula_reduced": "V2H2O5",
"formula_anonymous": "A2B2C5",
"energy_above_hull": 3.1853228777777782,
"spacegroup": 12
},
{
"id": "jvasp-30641",
"created_at": "2022-09-04T14:37:29.391347Z",
"updated_at": "2022-09-04T14:37:29.391365Z",
"structure_string": "Se2 Cl2 O5\n1.0\n3.639838 -0.000000 -0.588558\n-0.095169 3.638593 -0.588558\n-0.152318 -0.156354 10.607281\nSe Cl O\n2 2 5\ndirect\n0.087564 0.087564 0.175127 Se\n0.912436 0.912436 0.824873 Se\n0.208006 0.208007 0.416012 Cl\n0.791993 0.791993 0.583987 Cl\n0.399966 0.899967 0.799932 O\n0.899967 0.399967 0.799932 O\n0.600034 0.100033 0.200068 O\n0.100033 0.600033 0.200067 O\n0.000000 0.000000 0.000000 O\n",
"nsites": 9,
"nelements": 3,
"elements": [
"Se",
"Cl",
"O"
],
"chemical_system": "Cl-O-Se",
"density": 3.6678794706772835,
"density_atomic": 0.06437227092441167,
"volume": 139.81175233926635,
"volume_molar": 9.35517836099246,
"formula_full": "Se2 Cl2 O5",
"formula_reduced": "Se2Cl2O5",
"formula_anonymous": "A2B2C5",
"energy_above_hull": 1.9840235964814812,
"spacegroup": 139
},
{
"id": "jvasp-85960",
"created_at": "2022-09-04T14:35:52.322761Z",
"updated_at": "2022-09-04T14:35:52.322789Z",
"structure_string": "La4 Pd4 O10\n1.0\n5.653002 0.000000 0.000000\n0.000000 6.724680 -0.000000\n0.000000 0.000000 6.724680\nLa Pd O\n4 4 10\ndirect\n0.500000 0.107271 0.737076 La\n0.000000 0.737076 0.892729 La\n0.500000 0.892729 0.262924 La\n0.000000 0.262924 0.107271 La\n0.000000 0.309003 0.595305 Pd\n0.500000 0.404695 0.309003 Pd\n0.000000 0.690997 0.404695 Pd\n0.500000 0.595305 0.690997 Pd\n0.742092 0.800242 0.594621 O\n0.242092 0.594621 0.199758 O\n0.757908 0.594621 0.199758 O\n0.750000 0.000000 0.000000 O\n0.257908 0.800242 0.594621 O\n0.742092 0.199758 0.405379 O\n0.757908 0.405379 0.800242 O\n0.250000 0.000000 0.000000 O\n0.257908 0.199758 0.405379 O\n0.242092 0.405379 0.800242 O\n",
"nsites": 18,
"nelements": 3,
"elements": [
"La",
"Pd",
"O"
],
"chemical_system": "La-O-Pd",
"density": 7.413528510993978,
"density_atomic": 0.07041255772029364,
"volume": 255.6362186345094,
"volume_molar": 8.552651622061946,
"formula_full": "La4 Pd4 O10",
"formula_reduced": "La2Pd2O5",
"formula_anonymous": "A2B2C5",
"energy_above_hull": 2.2507865444444444,
"spacegroup": 84
},
{
"id": "jvasp-20931",
"created_at": "2022-09-04T14:38:15.886417Z",
"updated_at": "2022-09-04T14:38:15.886447Z",
"structure_string": "Ca8 B8 O20\n1.0\n0.000000 7.193193 0.066067\n5.204576 0.000000 0.000000\n0.000000 -0.604763 -11.527511\nCa B O\n8 8 20\ndirect\n0.381178 0.563307 0.632637 Ca\n0.618822 0.063306 0.867363 Ca\n0.618822 0.436694 0.367363 Ca\n0.381178 0.936695 0.132637 Ca\n0.875645 0.600851 0.665290 Ca\n0.124355 0.100851 0.834710 Ca\n0.124355 0.399149 0.334710 Ca\n0.875645 0.899150 0.165290 Ca\n0.845031 0.923028 0.404644 B\n0.154968 0.423028 0.095356 B\n0.154968 0.076973 0.595356 B\n0.845032 0.576973 0.904644 B\n0.337914 0.561900 0.910984 B\n0.337914 0.938101 0.410984 B\n0.662086 0.438101 0.089016 B\n0.662086 0.061900 0.589015 B\n0.409341 0.418745 0.825008 O\n0.145436 0.645379 0.156370 O\n0.854563 0.145378 0.343629 O\n0.106147 0.306192 0.641841 O\n0.893853 0.806192 0.858159 O\n0.893853 0.693809 0.358159 O\n0.106147 0.193809 0.141841 O\n0.590659 0.918746 0.674991 O\n0.409341 0.081255 0.325008 O\n0.230322 0.406081 0.985026 O\n0.643591 0.320514 0.571605 O\n0.356409 0.820515 0.928394 O\n0.356409 0.679486 0.428394 O\n0.643591 0.179486 0.071605 O\n0.769678 0.593920 0.014973 O\n0.230321 0.093919 0.485027 O\n0.145437 0.854622 0.656370 O\n0.769678 0.906081 0.514973 O\n0.590659 0.581255 0.174991 O\n0.854563 0.354622 0.843629 O\n",
"nsites": 36,
"nelements": 3,
"elements": [
"Ca",
"B",
"O"
],
"chemical_system": "B-Ca-O",
"density": 2.799045412604586,
"density_atomic": 0.08345823642825485,
"volume": 431.35347139700843,
"volume_molar": 7.215753672409496,
"formula_full": "Ca8 B8 O20",
"formula_reduced": "Ca2B2O5",
"formula_anonymous": "A2B2C5",
"energy_above_hull": 2.3066692785185183,
"spacegroup": 14
},
{
"id": "jvasp-50462",
"created_at": "2022-09-04T14:37:38.115177Z",
"updated_at": "2022-09-04T14:37:38.115201Z",
"structure_string": "Li4 Zr4 O10\n1.0\n4.487152 3.267030 0.967316\n-4.487152 3.267030 -0.967316\n1.564479 0.000000 7.454693\nLi Zr O\n4 4 10\ndirect\n0.785294 0.814472 0.455218 Li\n0.185528 0.214706 -0.044781 Li\n0.814472 0.785294 0.044781 Li\n0.214706 0.185528 0.544781 Li\n0.221343 0.718846 0.621678 Zr\n0.281154 0.778657 0.121679 Zr\n0.718846 0.221343 0.878321 Zr\n0.778657 0.281154 0.378321 Zr\n0.365247 0.926375 0.871150 O\n0.500000 0.500000 0.000000 O\n0.023591 0.023591 0.250000 O\n0.500000 0.500000 0.500000 O\n0.000000 0.500000 -0.000000 O\n0.634753 0.073625 0.128850 O\n0.926375 0.365247 0.628849 O\n0.073625 0.634753 0.371150 O\n0.976409 0.976409 0.750000 O\n0.500000 0.000000 0.500000 O\n",
"nsites": 18,
"nelements": 3,
"elements": [
"Li",
"Zr",
"O"
],
"chemical_system": "Li-O-Zr",
"density": 4.3976964223198225,
"density_atomic": 0.08625719598772279,
"volume": 208.67824178474322,
"volume_molar": 6.9816096976502084,
"formula_full": "Li4 Zr4 O10",
"formula_reduced": "Li2Zr2O5",
"formula_anonymous": "A2B2C5",
"energy_above_hull": 2.5533851666666667,
"spacegroup": 15
},
{
"id": "jvasp-99115",
"created_at": "2022-09-04T14:35:59.389617Z",
"updated_at": "2022-09-04T14:35:59.389644Z",
"structure_string": "Na8 Si8 O20\n1.0\n4.862275 -0.018960 0.000000\n-0.087308 8.434243 0.000000\n0.000000 0.000000 12.004751\nNa Si O\n8 8 20\ndirect\n0.758679 0.367618 0.998917 Na\n0.231307 0.116892 0.958754 Na\n0.258680 0.867618 0.501083 Na\n0.741319 0.132382 0.498917 Na\n0.731306 0.616892 0.541246 Na\n0.268693 0.383108 0.458754 Na\n0.241319 0.632382 0.001083 Na\n0.768692 0.883108 0.041246 Na\n0.692254 0.045616 0.799689 Si\n0.195726 0.173406 0.676071 Si\n0.804273 0.826594 0.323929 Si\n0.304274 0.326594 0.176071 Si\n0.307744 0.954384 0.200311 Si\n0.807744 0.454384 0.299689 Si\n0.695725 0.673406 0.823929 Si\n0.192255 0.545616 0.700311 Si\n0.638967 0.937054 0.232161 O\n0.863153 0.138779 0.699371 O\n0.138967 0.437054 0.267839 O\n0.765295 0.856944 0.786342 O\n0.363154 0.638779 0.800629 O\n0.234703 0.143056 0.213658 O\n0.248828 0.609477 0.576396 O\n0.751170 0.390523 0.423604 O\n0.251171 0.890523 0.076396 O\n0.738674 0.862126 0.452051 O\n0.861031 0.562946 0.732161 O\n0.265296 0.356944 0.713657 O\n0.748828 0.109477 0.923604 O\n0.361032 0.062946 0.767839 O\n0.261325 0.137874 0.547949 O\n0.761324 0.637874 0.952051 O\n0.238675 0.362126 0.047949 O\n0.136845 0.861220 0.300629 O\n0.734702 0.643056 0.286342 O\n0.636845 0.361220 0.199371 O\n",
"nsites": 36,
"nelements": 3,
"elements": [
"Na",
"Si",
"O"
],
"chemical_system": "Na-O-Si",
"density": 2.457599684101966,
"density_atomic": 0.07312758775858874,
"volume": 492.29027106492856,
"volume_molar": 8.235114742032097,
"formula_full": "Na8 Si8 O20",
"formula_reduced": "Na2Si2O5",
"formula_anonymous": "A2B2C5",
"energy_above_hull": 1.9276980777777772,
"spacegroup": 14
},
{
"id": "jvasp-52580",
"created_at": "2022-09-04T14:36:32.978240Z",
"updated_at": "2022-09-04T14:36:32.978260Z",
"structure_string": "Ba4 In4 O10\n1.0\n8.808695 -4.077951 -4.077951\n4.405744 4.169768 -0.082926\n4.405744 -0.082926 4.169768\nBa In O\n4 4 10\ndirect\n0.625000 0.104768 0.145233 Ba\n0.125000 0.645232 0.604767 Ba\n0.875000 0.375000 0.375000 Ba\n0.375000 0.875000 0.875000 Ba\n0.012886 0.968318 0.005351 In\n0.237114 0.244648 0.281682 In\n0.512886 0.505352 0.468318 In\n0.737114 0.781682 0.744648 In\n0.625000 0.621262 0.628737 O\n0.375000 0.875000 0.374999 O\n0.579397 0.117133 0.732562 O\n0.670603 0.517439 0.132866 O\n0.125000 0.128738 0.121262 O\n0.170603 0.632866 0.017438 O\n0.079397 0.232561 0.617134 O\n0.875000 0.875000 0.375000 O\n0.375000 0.375000 0.375000 O\n0.875000 0.875000 0.875000 O\n",
"nsites": 18,
"nelements": 3,
"elements": [
"Ba",
"In",
"O"
],
"chemical_system": "Ba-In-O",
"density": 6.3433059637336315,
"density_atomic": 0.05884137978338955,
"volume": 305.90717053649473,
"volume_molar": 10.234533558133865,
"formula_full": "Ba4 In4 O10",
"formula_reduced": "Ba2In2O5",
"formula_anonymous": "A2B2C5",
"energy_above_hull": 1.145897708888889,
"spacegroup": 15
},
{
"id": "jvasp-107757",
"created_at": "2022-09-04T14:38:49.382528Z",
"updated_at": "2022-09-04T14:38:49.382555Z",
"structure_string": "Ge2 Sb2 Te5\n1.0\n5.738308 0.006559 4.927405\n2.459491 5.184508 4.927405\n0.067821 0.042946 9.786685\nGe Sb Te\n2 2 5\ndirect\n0.508821 0.508821 0.006624 Ge\n0.720952 0.720953 0.199675 Ge\n0.888889 0.888890 0.429402 Sb\n0.108284 0.108285 0.578193 Sb\n0.588859 0.588860 0.599082 Te\n0.786554 0.786556 0.811524 Te\n-0.002149 -0.002149 -0.003584 Te\n0.199227 0.199227 0.190389 Te\n0.400562 0.400562 0.388700 Te\n",
"nsites": 9,
"nelements": 3,
"elements": [
"Ge",
"Sb",
"Te"
],
"chemical_system": "Ge-Sb-Te",
"density": 5.90849146178921,
"density_atomic": 0.031187758616092888,
"volume": 288.57476136024724,
"volume_molar": 19.309309252164642,
"formula_full": "Ge2 Sb2 Te5",
"formula_reduced": "Ge2Sb2Te5",
"formula_anonymous": "A2B2C5",
"energy_above_hull": 1.225000325925926,
"spacegroup": 8
},
{
"id": "jvasp-38269",
"created_at": "2022-09-04T14:38:28.454173Z",
"updated_at": "2022-09-04T14:38:28.454201Z",
"structure_string": "Rb2 Bi2 O5\n1.0\n4.381772 0.000000 0.000000\n0.000000 4.381772 -0.000000\n0.000000 0.000000 8.872089\nRb Bi O\n2 2 5\ndirect\n0.000000 0.000000 0.000000 Rb\n0.000000 0.000000 0.500000 Rb\n0.500000 0.500000 0.261252 Bi\n0.500000 0.500000 0.738748 Bi\n0.500000 0.000000 0.228389 O\n0.500000 0.000000 0.771611 O\n0.500000 0.500000 0.500000 O\n0.000000 0.500000 0.228389 O\n0.000000 0.500000 0.771611 O\n",
"nsites": 9,
"nelements": 3,
"elements": [
"Rb",
"Bi",
"O"
],
"chemical_system": "Bi-O-Rb",
"density": 6.520495008286275,
"density_atomic": 0.05283443505424414,
"volume": 170.3434510231796,
"volume_molar": 11.398135995619485,
"formula_full": "Rb2 Bi2 O5",
"formula_reduced": "Rb2Bi2O5",
"formula_anonymous": "A2B2C5",
"energy_above_hull": 1.4265895666666666,
"spacegroup": 123
},
{
"id": "jvasp-9625",
"created_at": "2022-09-04T14:37:12.336832Z",
"updated_at": "2022-09-04T14:37:12.336859Z",
"structure_string": "V4 Zn4 O10\n1.0\n0.000000 7.485122 -0.000248\n3.265964 0.000000 0.000000\n0.000000 0.000116 -10.297905\nV Zn O\n4 4 10\ndirect\n0.692956 0.000000 0.397342 V\n0.307035 0.000000 0.602675 V\n0.807042 0.000000 0.897330 V\n0.192952 0.000000 0.102653 V\n0.593561 0.499999 0.128953 Zn\n0.406414 0.499999 0.871058 Zn\n0.093574 0.499999 0.371050 Zn\n0.906410 0.499999 0.628940 Zn\n0.831872 0.499999 0.435812 O\n0.152609 0.000000 0.282910 O\n0.331869 0.499999 0.064180 O\n0.668130 0.499999 0.935828 O\n0.500050 0.000000 0.500062 O\n0.347385 0.000000 0.782916 O\n0.847380 0.000000 0.717083 O\n0.000047 0.000000 -0.000058 O\n0.652598 0.000000 0.217093 O\n0.168122 0.499999 0.564172 O\n",
"nsites": 18,
"nelements": 3,
"elements": [
"V",
"Zn",
"O"
],
"chemical_system": "O-V-Zn",
"density": 4.125200285690779,
"density_atomic": 0.0715012027994628,
"volume": 251.74401681722807,
"volume_molar": 8.422432804228638,
"formula_full": "V4 Zn4 O10",
"formula_reduced": "V2Zn2O5",
"formula_anonymous": "A2B2C5",
"energy_above_hull": 2.111019633333333,
"spacegroup": 55
}
]
}