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=volume&page=3612",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=volume&page=3610",
"results": [
{
"id": "jvasp-100621",
"created_at": "2022-09-04T14:37:00.069123Z",
"updated_at": "2022-09-04T14:37:00.069144Z",
"structure_string": "Rb3 Eu1 F6\n1.0\n6.094281 0.011521 -3.387667\n-2.103522 5.719754 -3.387667\n-0.008022 -0.011521 6.972552\nRb Eu F\n3 1 6\ndirect\n0.750000 0.250000 0.499999 Rb\n0.250000 0.750000 0.499999 Rb\n0.500000 0.500000 -0.000001 Rb\n0.000000 0.000000 0.000000 Eu\n0.000000 0.311778 0.311778 F\n0.000000 0.688221 0.688221 F\n0.311778 -0.000000 0.311778 F\n0.688222 -0.000000 0.688221 F\n0.232414 0.232414 -0.000000 F\n0.767586 0.767585 -0.000001 F\n",
"nsites": 10,
"nelements": 3,
"elements": [
"Rb",
"Eu",
"F"
],
"chemical_system": "Eu-F-Rb",
"density": 3.5733283169809864,
"density_atomic": 0.04119606392979201,
"volume": 242.74163709043665,
"volume_molar": 14.618243068714465,
"formula_full": "Rb3 Eu1 F6",
"formula_reduced": "Rb3EuF6",
"formula_anonymous": "AB3C6",
"energy_above_hull": 0.0,
"spacegroup": 139
},
{
"id": "jvasp-18579",
"created_at": "2022-09-04T14:36:01.051912Z",
"updated_at": "2022-09-04T14:36:01.051934Z",
"structure_string": "Ho6 Fe1 Bi2\n1.0\n4.129799 -7.153022 0.000000\n4.129799 7.153022 0.000000\n-0.000000 0.000000 4.108637\nHo Fe Bi\n6 1 2\ndirect\n0.000000 0.770542 0.000000 Ho\n0.389511 0.000000 0.500000 Ho\n0.610489 0.610489 0.500000 Ho\n0.229458 0.229458 0.000000 Ho\n0.770542 0.000000 0.000000 Ho\n0.000000 0.389511 0.500000 Ho\n0.000000 0.000000 0.500000 Fe\n0.333333 0.666667 0.000000 Bi\n0.666667 0.333333 0.000000 Bi\n",
"nsites": 9,
"nelements": 3,
"elements": [
"Ho",
"Fe",
"Bi"
],
"chemical_system": "Bi-Fe-Ho",
"density": 10.010649590797357,
"density_atomic": 0.03707628957012591,
"volume": 242.74273678269356,
"volume_molar": 16.242565881922335,
"formula_full": "Ho6 Fe1 Bi2",
"formula_reduced": "Ho6FeBi2",
"formula_anonymous": "AB2C6",
"energy_above_hull": 1.7434675000000002,
"spacegroup": 189
},
{
"id": "jvasp-50286",
"created_at": "2022-09-04T14:36:40.415583Z",
"updated_at": "2022-09-04T14:36:40.415607Z",
"structure_string": "Lu6 Te1 O12\n1.0\n6.323451 0.016606 0.020109\n-0.989130 6.245633 0.020108\n-0.989131 -1.161193 6.136771\nLu Te O\n6 1 12\ndirect\n0.144657 0.318692 0.609705 Lu\n0.390296 0.855343 0.681308 Lu\n0.318692 0.609704 0.144657 Lu\n0.681308 0.390296 0.855343 Lu\n0.609705 0.144657 0.318692 Lu\n0.855343 0.681308 0.390296 Lu\n0.000000 0.000000 0.000000 Te\n0.822714 0.409800 0.571021 O\n0.696662 0.037282 0.924902 O\n0.590201 0.428979 0.177286 O\n0.571021 0.822714 0.409800 O\n0.428979 0.177286 0.590201 O\n0.177286 0.590201 0.428979 O\n0.303339 0.962718 0.075099 O\n0.924902 0.696662 0.037282 O\n0.075099 0.303339 0.962718 O\n0.037282 0.924902 0.696662 O\n0.409800 0.571022 0.822714 O\n0.962718 0.075099 0.303339 O\n",
"nsites": 19,
"nelements": 3,
"elements": [
"Lu",
"Te",
"O"
],
"chemical_system": "Lu-O-Te",
"density": 9.366971966310855,
"density_atomic": 0.07826634438923263,
"volume": 242.7607951830429,
"volume_molar": 7.694419366325337,
"formula_full": "Lu6 Te1 O12",
"formula_reduced": "Lu6TeO12",
"formula_anonymous": "AB6C12",
"energy_above_hull": 2.331569171929824,
"spacegroup": 148
},
{
"id": "jvasp-9399",
"created_at": "2022-09-04T14:36:52.309221Z",
"updated_at": "2022-09-04T14:36:52.309247Z",
"structure_string": "Nb4 Sn2 O12\n1.0\n4.764743 -0.000000 -1.370584\n-0.027964 5.656103 -0.097215\n0.011007 -0.032508 9.005712\nNb Sn O\n4 2 12\ndirect\n0.929271 0.675535 0.339383 Nb\n0.589890 0.824464 0.660619 Nb\n0.070730 0.324464 0.660618 Nb\n0.410111 0.175536 0.339382 Nb\n0.231793 0.750000 0.000001 Sn\n0.768207 0.250000 0.000000 Sn\n0.398621 0.570060 0.716192 O\n0.682430 0.929939 0.283809 O\n0.152879 0.092559 0.144502 O\n0.718611 0.148058 0.561356 O\n0.991623 0.592559 0.144503 O\n0.317571 0.070060 0.716192 O\n0.601379 0.429939 0.283808 O\n0.842744 0.648058 0.561356 O\n0.281390 0.851941 0.438645 O\n0.157256 0.351941 0.438645 O\n0.847122 0.907440 0.855499 O\n0.008378 0.407440 0.855498 O\n",
"nsites": 18,
"nelements": 3,
"elements": [
"Nb",
"Sn",
"O"
],
"chemical_system": "Nb-O-Sn",
"density": 5.479034691164926,
"density_atomic": 0.07414368475023461,
"volume": 242.771856573301,
"volume_molar": 8.122257182505276,
"formula_full": "Nb4 Sn2 O12",
"formula_reduced": "Nb2SnO6",
"formula_anonymous": "AB2C6",
"energy_above_hull": 3.1247868333333337,
"spacegroup": 15
},
{
"id": "jvasp-34372",
"created_at": "2022-09-04T14:37:14.554944Z",
"updated_at": "2022-09-04T14:37:14.554969Z",
"structure_string": "Na6 Ni2 F12\n1.0\n0.000000 5.425831 0.016426\n5.717163 0.000000 0.000000\n0.000000 -5.358572 -7.842596\nNa Ni F\n6 2 12\ndirect\n0.726277 0.564645 0.746550 Na\n0.273724 0.064645 0.753450 Na\n0.273723 0.435355 0.253450 Na\n0.726276 0.935355 0.246550 Na\n0.500000 0.500000 -0.000000 Na\n0.500000 0.000000 0.500000 Na\n0.000000 0.500000 0.500000 Ni\n0.000000 0.000000 0.000000 Ni\n0.893048 0.552073 0.275027 F\n0.106952 0.052073 0.224973 F\n0.333558 0.175829 0.051858 F\n0.666442 0.675829 0.448142 F\n0.666442 0.824170 0.948142 F\n0.240111 0.721276 0.071201 F\n0.759890 0.278723 0.928799 F\n0.240111 0.778723 0.571201 F\n0.893049 0.947927 0.775027 F\n0.759889 0.221276 0.428799 F\n0.333559 0.324170 0.551858 F\n0.106952 0.447927 0.724974 F\n",
"nsites": 20,
"nelements": 3,
"elements": [
"Na",
"Ni",
"F"
],
"chemical_system": "F-Na-Ni",
"density": 3.3057050330229867,
"density_atomic": 0.08238015071697892,
"volume": 242.77692898027084,
"volume_molar": 7.310184197998572,
"formula_full": "Na6 Ni2 F12",
"formula_reduced": "Na3NiF6",
"formula_anonymous": "AB3C6",
"energy_above_hull": 0.0,
"spacegroup": 14
},
{
"id": "jvasp-31826",
"created_at": "2022-09-04T14:37:59.102949Z",
"updated_at": "2022-09-04T14:37:59.102978Z",
"structure_string": "Cr1 Si1 H12 O6 F6\n1.0\n6.279703 -0.019343 -0.021728\n-0.670556 6.243828 -0.021728\n-0.670556 -0.744118 6.199366\nCr Si H O F\n1 1 12 6 6\ndirect\n0.000000 0.000000 0.000000 Cr\n0.499999 0.500000 0.500000 Si\n0.422603 0.192834 0.062127 H\n0.821592 0.324845 0.225159 H\n0.937871 0.577397 0.807166 H\n0.807165 0.937873 0.577396 H\n0.774840 0.178408 0.675155 H\n0.675154 0.774842 0.178407 H\n0.324844 0.225159 0.821593 H\n0.225158 0.821593 0.324845 H\n0.577395 0.807167 0.937873 H\n0.062127 0.422604 0.192834 H\n0.178407 0.675155 0.774841 H\n0.192833 0.062128 0.422604 H\n0.938510 0.314401 0.133441 O\n0.061489 0.685599 0.866559 O\n0.133440 0.938511 0.314400 O\n0.314400 0.133441 0.938511 O\n0.685599 0.866560 0.061489 O\n0.866558 0.061490 0.685599 O\n0.292775 0.328890 0.569410 F\n0.707223 0.671111 0.430590 F\n0.671109 0.430591 0.707224 F\n0.569409 0.292776 0.328890 F\n0.430590 0.707224 0.671110 F\n0.328889 0.569410 0.292776 F\n",
"nsites": 26,
"nelements": 5,
"elements": [
"Cr",
"Si",
"H",
"O",
"F"
],
"chemical_system": "Cr-F-H-O-Si",
"density": 2.06662582443724,
"density_atomic": 0.10708874127065832,
"volume": 242.78929504164267,
"volume_molar": 5.6235050375459315,
"formula_full": "Cr1 Si1 H12 O6 F6",
"formula_reduced": "CrSiH12(OF)6",
"formula_anonymous": "ABC6D6E12",
"energy_above_hull": 2.5159645651923075,
"spacegroup": 148
},
{
"id": "jvasp-61888",
"created_at": "2022-09-04T14:36:22.266168Z",
"updated_at": "2022-09-04T14:36:22.266195Z",
"structure_string": "Y4 Ni4 B16\n1.0\n-3.775221 3.775221 4.258806\n3.775221 -3.775221 4.258806\n3.775221 3.775221 -4.258806\nY Ni B\n4 4 16\ndirect\n0.250000 0.750000 0.500000 Y\n0.204059 0.204059 0.000000 Y\n0.795941 0.795941 0.000000 Y\n0.750000 0.250000 0.500000 Y\n0.500000 0.728419 0.228418 Ni\n0.500000 0.271582 0.771581 Ni\n0.728419 0.500000 0.228418 Ni\n0.271582 0.500000 0.771581 Ni\n0.887635 0.887635 0.469475 B\n0.418160 0.418160 0.530525 B\n0.418160 0.887635 0.000000 B\n0.887635 0.418160 0.000000 B\n0.274965 0.111344 0.386309 B\n0.581841 0.581841 0.469475 B\n0.112365 0.112365 0.530525 B\n0.888656 0.725035 0.613691 B\n0.111344 0.274965 0.386309 B\n0.274965 0.888656 0.163621 B\n0.725035 0.111344 0.836379 B\n0.111344 0.725035 0.836379 B\n0.888656 0.274965 0.163621 B\n0.725035 0.888656 0.613691 B\n0.581841 0.112366 0.000000 B\n0.112366 0.581841 0.000000 B\n",
"nsites": 24,
"nelements": 3,
"elements": [
"Y",
"Ni",
"B"
],
"chemical_system": "B-Ni-Y",
"density": 5.22099507786624,
"density_atomic": 0.09885044593521604,
"volume": 242.7910139700226,
"volume_molar": 6.09217358912751,
"formula_full": "Y4 Ni4 B16",
"formula_reduced": "YNiB4",
"formula_anonymous": "ABC4",
"energy_above_hull": 3.939833030555556,
"spacegroup": 139
},
{
"id": "jvasp-50084",
"created_at": "2022-09-04T14:37:04.672370Z",
"updated_at": "2022-09-04T14:37:04.672397Z",
"structure_string": "Cd4 B6 O13\n1.0\n-3.929996 3.929996 3.929996\n3.929996 -3.929996 3.929996\n3.929996 3.929996 -3.929996\nCd B O\n4 6 13\ndirect\n0.683224 0.000000 0.000000 Cd\n0.316777 0.316777 0.316777 Cd\n0.000000 0.683224 0.000000 Cd\n0.000000 0.000000 0.683224 Cd\n0.750001 0.500000 0.250000 B\n0.750001 0.250000 0.500000 B\n0.500000 0.250000 0.750001 B\n0.500000 0.750001 0.250000 B\n0.250000 0.750001 0.500000 B\n0.250000 0.500000 0.750001 B\n0.291750 0.584788 0.584788 O\n0.293038 0.708251 0.293038 O\n0.293038 0.293038 0.708251 O\n0.584788 0.584788 0.291750 O\n0.584788 0.291750 0.584788 O\n0.706963 0.415213 0.000000 O\n0.415213 0.706963 0.000000 O\n0.000000 0.000000 0.000000 O\n0.708251 0.293038 0.293038 O\n0.000000 0.706963 0.415213 O\n0.706963 0.000000 0.415213 O\n0.415213 0.000000 0.706963 O\n0.000000 0.415213 0.706963 O\n",
"nsites": 23,
"nelements": 3,
"elements": [
"Cd",
"B",
"O"
],
"chemical_system": "B-Cd-O",
"density": 4.941422119468792,
"density_atomic": 0.09473086864939001,
"volume": 242.79308664555458,
"volume_molar": 6.357104971019156,
"formula_full": "Cd4 B6 O13",
"formula_reduced": "Cd4B6O13",
"formula_anonymous": "A4B6C13",
"energy_above_hull": 2.709151304347825,
"spacegroup": 217
},
{
"id": "jvasp-52538",
"created_at": "2022-09-04T14:38:08.582581Z",
"updated_at": "2022-09-04T14:38:08.582604Z",
"structure_string": "Li6 Fe2 S6\n1.0\n3.483996 5.626632 0.075345\n-3.483996 5.626632 -0.075345\n-1.217357 0.000000 6.166452\nLi Fe S\n6 2 6\ndirect\n0.435245 0.564755 0.684665 Li\n0.823082 0.823083 0.500000 Li\n0.176917 0.176917 0.500000 Li\n0.242839 0.242839 -0.000000 Li\n0.757161 0.757161 0.000000 Li\n0.564754 0.435245 0.315335 Li\n0.171223 0.828777 0.132200 Fe\n0.828776 0.171223 0.867800 Fe\n0.123193 0.876807 0.766303 S\n0.160120 0.513343 0.258392 S\n0.486657 0.839880 0.258392 S\n0.839879 0.486657 0.741608 S\n0.513343 0.160120 0.741608 S\n0.876807 0.123194 0.233696 S\n",
"nsites": 14,
"nelements": 3,
"elements": [
"Li",
"Fe",
"S"
],
"chemical_system": "Fe-Li-S",
"density": 2.36450060884939,
"density_atomic": 0.05766155191661769,
"volume": 242.79610129545074,
"volume_molar": 10.443944985574449,
"formula_full": "Li6 Fe2 S6",
"formula_reduced": "Li3FeS3",
"formula_anonymous": "AB3C3",
"energy_above_hull": 1.6845365,
"spacegroup": 12
},
{
"id": "jvasp-22273",
"created_at": "2022-09-04T14:37:47.563287Z",
"updated_at": "2022-09-04T14:37:47.563308Z",
"structure_string": "Nd1 Fe4 P12\n1.0\n6.417704 0.000000 -2.269002\n-3.208852 5.557895 -2.269002\n-0.000000 -0.000000 6.807004\nNd Fe P\n1 4 12\ndirect\n0.000000 0.000000 0.000000 Nd\n0.000000 0.500000 0.000000 Fe\n0.000000 0.000000 0.500000 Fe\n0.500000 -0.000000 0.000000 Fe\n0.500000 0.500000 0.500000 Fe\n0.647832 0.496604 0.848772 P\n0.848772 0.352169 0.200941 P\n0.647832 0.799060 0.151228 P\n0.496604 0.848773 0.647832 P\n0.151228 0.647832 0.799059 P\n0.503396 0.151228 0.352168 P\n0.352169 0.503397 0.151228 P\n0.151228 0.352169 0.503396 P\n0.799059 0.151228 0.647831 P\n0.200941 0.848773 0.352169 P\n0.352168 0.200941 0.848772 P\n0.848772 0.647832 0.496604 P\n",
"nsites": 17,
"nelements": 3,
"elements": [
"Nd",
"Fe",
"P"
],
"chemical_system": "Fe-Nd-P",
"density": 5.056243424689088,
"density_atomic": 0.07001690270749253,
"volume": 242.79851496745547,
"volume_molar": 8.600981373252846,
"formula_full": "Nd1 Fe4 P12",
"formula_reduced": "Nd(FeP3)4",
"formula_anonymous": "AB4C12",
"energy_above_hull": 3.7285235,
"spacegroup": 204
},
{
"id": "jvasp-47837",
"created_at": "2022-09-04T14:37:04.983581Z",
"updated_at": "2022-09-04T14:37:04.983604Z",
"structure_string": "Li4 Fe4 Si4 O16\n1.0\n5.566021 0.000000 0.000000\n0.000000 5.566021 0.000000\n0.000000 0.000000 7.837684\nLi Fe Si O\n4 4 4 16\ndirect\n0.768485 0.000000 0.750000 Li\n0.231515 0.000000 0.250000 Li\n0.000000 0.768485 0.500000 Li\n0.000000 0.231515 0.000000 Li\n0.500000 0.753926 0.500000 Fe\n0.753926 0.500000 0.750000 Fe\n0.246073 0.500000 0.250000 Fe\n0.500000 0.246073 0.000000 Fe\n0.251568 0.251568 0.625000 Si\n0.748432 0.251568 0.375000 Si\n0.251568 0.748432 0.874999 Si\n0.748432 0.748432 0.125000 Si\n0.004306 0.262215 0.739460 O\n0.995694 0.262215 0.260539 O\n0.497107 0.260209 0.752703 O\n0.502893 0.260209 0.247296 O\n0.260209 0.502893 0.002703 O\n0.739791 0.502893 -0.002703 O\n0.260209 0.497107 0.497296 O\n0.262215 0.004306 0.510539 O\n0.497107 0.739791 0.747296 O\n0.502893 0.739791 0.252703 O\n0.995694 0.737785 0.239460 O\n0.004306 0.737785 0.760539 O\n0.737785 0.995694 0.010540 O\n0.737785 0.004306 0.489460 O\n0.739791 0.497107 0.502703 O\n0.262215 0.995694 0.989460 O\n",
"nsites": 28,
"nelements": 4,
"elements": [
"Li",
"Fe",
"Si",
"O"
],
"chemical_system": "Fe-Li-O-Si",
"density": 4.236394861764342,
"density_atomic": 0.11531361857795679,
"volume": 242.81607277002448,
"volume_molar": 5.222402032183895,
"formula_full": "Li4 Fe4 Si4 O16",
"formula_reduced": "LiFeSiO4",
"formula_anonymous": "ABCD4",
"energy_above_hull": 2.441046871428572,
"spacegroup": 95
},
{
"id": "jvasp-46406",
"created_at": "2022-09-04T14:38:03.024781Z",
"updated_at": "2022-09-04T14:38:03.024798Z",
"structure_string": "Li8 Mn2 B4 O12\n1.0\n3.291963 0.000000 0.000000\n0.000000 7.936631 -0.000000\n0.000000 0.000000 9.293771\nLi Mn B O\n8 2 4 12\ndirect\n0.499999 0.832066 0.944944 Li\n0.000000 0.994747 0.797470 Li\n0.499999 0.494747 0.702530 Li\n0.000000 0.332066 0.555056 Li\n0.000000 0.667934 0.444944 Li\n0.499999 0.505253 0.297470 Li\n0.000000 0.005253 0.202530 Li\n0.499999 0.167934 0.055056 Li\n0.000000 0.500000 0.000000 Mn\n0.499999 0.000000 0.500000 Mn\n0.499999 0.765224 0.202128 B\n0.000000 0.265224 0.297872 B\n0.499999 0.234776 0.797872 B\n0.000000 0.734776 0.702128 B\n0.000000 0.247035 0.149428 O\n0.499999 0.380987 0.884991 O\n0.000000 0.752965 0.850571 O\n0.499999 0.079932 0.862563 O\n0.000000 0.579932 0.637437 O\n0.499999 0.252965 0.649428 O\n0.000000 0.880987 0.615009 O\n0.000000 0.119013 0.384991 O\n0.499999 0.747034 0.350572 O\n0.000000 0.420068 0.362563 O\n0.499999 0.920068 0.137437 O\n0.499999 0.619013 0.115009 O\n",
"nsites": 26,
"nelements": 4,
"elements": [
"Li",
"Mn",
"B",
"O"
],
"chemical_system": "B-Li-Mn-O",
"density": 2.739815182224096,
"density_atomic": 0.10707553338488532,
"volume": 242.81924337040132,
"volume_molar": 5.624198703127899,
"formula_full": "Li8 Mn2 B4 O12",
"formula_reduced": "Li4Mn(BO3)2",
"formula_anonymous": "AB2C4D6",
"energy_above_hull": 2.6986041083112293,
"spacegroup": 58
}
]
}