GET /third-parties/JarvisStructure/?format=api&ordering=formula_full&page=393
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_full&page=394",
    "previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=formula_full&page=392",
    "results": [
        {
            "id": "jvasp-11684",
            "created_at": "2022-09-04T14:38:09.784670Z",
            "updated_at": "2022-09-04T14:38:09.784696Z",
            "structure_string": "Ba3 Mn3 O9\n1.0\n5.306586 -0.002821 5.668511\n2.237378 4.811860 5.668511\n-0.004426 -0.002821 7.764783\nBa Mn O\n3 3 9\ndirect\n0.781744 0.781744 0.781743 Ba\n0.218256 0.218256 0.218256 Ba\n0.000000 0.000000 0.000000 Ba\n0.619044 0.619044 0.619043 Mn\n0.380956 0.380956 0.380956 Mn\n0.500000 0.500000 0.499999 Mn\n0.500000 0.000000 0.500000 O\n-0.000000 0.500000 0.500000 O\n0.500001 0.500000 -0.000001 O\n0.294040 0.294041 0.736606 O\n0.294041 0.736606 0.294040 O\n0.736606 0.294041 0.294040 O\n0.705959 0.263394 0.705959 O\n0.705960 0.705960 0.263393 O\n0.263394 0.705960 0.705959 O\n",
            "nsites": 15,
            "nelements": 3,
            "elements": [
                "Ba",
                "Mn",
                "O"
            ],
            "chemical_system": "Ba-Mn-O",
            "density": 6.0300511729873545,
            "density_atomic": 0.07557089509525737,
            "volume": 198.48911384591185,
            "volume_molar": 7.968862552718307,
            "formula_full": "Ba3 Mn3 O9",
            "formula_reduced": "BaMnO3",
            "formula_anonymous": "ABC3",
            "energy_above_hull": 1.8953127422758624,
            "spacegroup": 166
        },
        {
            "id": "jvasp-36447",
            "created_at": "2022-09-04T14:37:14.712153Z",
            "updated_at": "2022-09-04T14:37:14.712178Z",
            "structure_string": "Ba3 N2\n1.0\n5.316211 0.000000 0.000000\n-0.000000 5.316211 0.000000\n-0.000000 -0.000000 5.316211\nBa N\n3 2\ndirect\n0.000000 0.500000 0.500000 Ba\n0.500000 0.000000 0.500000 Ba\n0.500000 0.500000 0.000000 Ba\n0.000000 0.000000 0.000000 N\n0.500000 0.500000 0.500000 N\n",
            "nsites": 5,
            "nelements": 2,
            "elements": [
                "Ba",
                "N"
            ],
            "chemical_system": "Ba-N",
            "density": 4.862835934984246,
            "density_atomic": 0.03327847184348426,
            "volume": 150.24728369487832,
            "volume_molar": 18.0962058243642,
            "formula_full": "Ba3 N2",
            "formula_reduced": "Ba3N2",
            "formula_anonymous": "A2B3",
            "energy_above_hull": 2.055450882,
            "spacegroup": 221
        },
        {
            "id": "jvasp-109503",
            "created_at": "2022-09-04T14:38:27.602416Z",
            "updated_at": "2022-09-04T14:38:27.602436Z",
            "structure_string": "Ba3 Na1\n1.0\n5.401072 -0.042741 -5.422711\n-0.951327 5.316802 -5.422711\n0.036061 0.042741 7.653501\nBa Na\n3 1\ndirect\n0.749999 0.250000 0.500000 Ba\n0.249999 0.750000 0.499999 Ba\n0.500000 0.500000 -0.000000 Ba\n0.000000 0.000000 0.000000 Na\n",
            "nsites": 4,
            "nelements": 2,
            "elements": [
                "Ba",
                "Na"
            ],
            "chemical_system": "Ba-Na",
            "density": 3.2536811679405893,
            "density_atomic": 0.018018797925851038,
            "volume": 221.9903911715064,
            "volume_molar": 33.42143457505682,
            "formula_full": "Ba3 Na1",
            "formula_reduced": "Ba3Na",
            "formula_anonymous": "AB3",
            "energy_above_hull": 0.0,
            "spacegroup": 139
        },
        {
            "id": "jvasp-100709",
            "created_at": "2022-09-04T14:37:05.314493Z",
            "updated_at": "2022-09-04T14:37:05.314526Z",
            "structure_string": "Ba3 Na1\n1.0\n6.046798 -0.000000 0.000000\n0.000000 6.046798 0.000000\n-0.000000 -0.000000 6.046798\nBa Na\n3 1\ndirect\n-0.000000 0.500000 0.500000 Ba\n0.500000 0.000000 0.500000 Ba\n0.500000 0.500000 -0.000000 Ba\n0.000000 0.000000 0.000000 Na\n",
            "nsites": 4,
            "nelements": 2,
            "elements": [
                "Ba",
                "Na"
            ],
            "chemical_system": "Ba-Na",
            "density": 3.2668770340859568,
            "density_atomic": 0.018091876274114786,
            "volume": 221.09370744056312,
            "volume_molar": 33.28643568393326,
            "formula_full": "Ba3 Na1",
            "formula_reduced": "Ba3Na",
            "formula_anonymous": "AB3",
            "energy_above_hull": 0.0088749999999999,
            "spacegroup": 221
        },
        {
            "id": "jvasp-3036",
            "created_at": "2022-09-04T14:36:57.928108Z",
            "updated_at": "2022-09-04T14:36:57.928134Z",
            "structure_string": "Ba3 Na3 P3\n1.0\n3.978060 -6.890202 0.000000\n3.978060 6.890202 0.000000\n0.000000 0.000000 4.690300\nBa Na P\n3 3 3\ndirect\n0.412697 0.412697 0.500000 Ba\n0.000000 0.587303 0.500000 Ba\n0.587303 0.000000 0.500000 Ba\n0.000000 0.242318 0.000000 Na\n0.242318 0.000000 0.000000 Na\n0.757682 0.757682 0.000000 Na\n0.666667 0.333333 0.000000 P\n0.000000 0.000000 0.500000 P\n0.333333 0.666667 0.000000 P\n",
            "nsites": 9,
            "nelements": 3,
            "elements": [
                "Ba",
                "Na",
                "P"
            ],
            "chemical_system": "Ba-Na-P",
            "density": 3.706209155152977,
            "density_atomic": 0.03500326923141104,
            "volume": 257.11884054314646,
            "volume_molar": 17.20450944220914,
            "formula_full": "Ba3 Na3 P3",
            "formula_reduced": "BaNaP",
            "formula_anonymous": "ABC",
            "energy_above_hull": 0.2992901566666668,
            "spacegroup": 189
        },
        {
            "id": "jvasp-57387",
            "created_at": "2022-09-04T14:38:18.322379Z",
            "updated_at": "2022-09-04T14:38:18.322397Z",
            "structure_string": "Ba3 Nb1 Fe3 Si2 O14\n1.0\n4.324141 -7.489631 -0.000000\n4.324141 7.489631 0.000000\n0.000000 -0.000000 5.281363\nBa Nb Fe Si O\n3 1 3 2 14\ndirect\n0.432167 0.432167 0.000000 Ba\n-0.000000 0.567833 0.000000 Ba\n0.567833 -0.000000 0.000000 Ba\n0.000000 0.000000 0.000000 Nb\n0.254503 -0.000000 0.500000 Fe\n0.745497 0.745497 0.500000 Fe\n-0.000000 0.254503 0.500000 Fe\n0.666667 0.333333 0.522939 Si\n0.333333 0.666667 0.477060 Si\n0.823218 0.298508 0.649332 O\n0.475291 0.176781 0.649332 O\n0.666667 0.333333 0.217626 O\n0.781628 0.894671 0.775175 O\n0.894671 0.781628 0.224824 O\n0.524709 0.701492 0.350667 O\n0.701492 0.524709 0.649332 O\n0.333333 0.666667 0.782373 O\n0.218371 0.113043 0.224824 O\n0.113043 0.218371 0.775175 O\n0.176781 0.475291 0.350667 O\n0.298508 0.823218 0.350667 O\n0.105329 0.886957 0.775175 O\n0.886957 0.105329 0.224824 O\n",
            "nsites": 23,
            "nelements": 5,
            "elements": [
                "Ba",
                "Nb",
                "Fe",
                "Si",
                "O"
            ],
            "chemical_system": "Ba-Fe-Nb-O-Si",
            "density": 4.623986361965426,
            "density_atomic": 0.06723440310124157,
            "volume": 342.08677312664764,
            "volume_molar": 8.95693347783851,
            "formula_full": "Ba3 Nb1 Fe3 Si2 O14",
            "formula_reduced": "Ba3NbFe3(SiO7)2",
            "formula_anonymous": "AB2C3D3E14",
            "energy_above_hull": 2.937662609130435,
            "spacegroup": 150
        },
        {
            "id": "jvasp-49154",
            "created_at": "2022-09-04T14:38:31.292972Z",
            "updated_at": "2022-09-04T14:38:31.292999Z",
            "structure_string": "Ba3 Nb1 Ga3 Si2 O14\n1.0\n4.302892 -7.452827 0.000000\n4.302892 7.452827 -0.000000\n0.000000 -0.000000 5.261464\nBa Nb Ga Si O\n3 1 3 2 14\ndirect\n0.568625 0.568625 0.000000 Ba\n-0.000000 0.431375 0.000000 Ba\n0.431375 -0.000000 0.000000 Ba\n0.000000 0.000000 0.000000 Nb\n0.256300 0.256300 0.500000 Ga\n-0.000000 0.743700 0.500000 Ga\n0.743700 -0.000000 0.500000 Ga\n0.666667 0.333333 0.520678 Si\n0.333333 0.666667 0.479321 Si\n0.474744 0.298964 0.648099 O\n0.666667 0.333333 0.214568 O\n0.333333 0.666667 0.785431 O\n0.175781 0.701036 0.351900 O\n0.525255 0.824219 0.351900 O\n0.298964 0.474744 0.351900 O\n0.111484 0.892686 0.773096 O\n0.892686 0.111484 0.226903 O\n0.888516 0.781202 0.226903 O\n0.701036 0.175781 0.648099 O\n0.781202 0.888516 0.773096 O\n0.107314 0.218798 0.773096 O\n0.218798 0.107314 0.226903 O\n0.824219 0.525255 0.648099 O\n",
            "nsites": 23,
            "nelements": 5,
            "elements": [
                "Ba",
                "Nb",
                "Ga",
                "Si",
                "O"
            ],
            "chemical_system": "Ba-Ga-Nb-O-Si",
            "density": 4.892299796295231,
            "density_atomic": 0.06815688778568538,
            "volume": 337.45672297012607,
            "volume_molar": 8.835703852758368,
            "formula_full": "Ba3 Nb1 Ga3 Si2 O14",
            "formula_reduced": "Ba3NbGa3(SiO7)2",
            "formula_anonymous": "AB2C3D3E14",
            "energy_above_hull": 2.284294368913044,
            "spacegroup": 150
        },
        {
            "id": "jvasp-85355",
            "created_at": "2022-09-04T14:36:07.129598Z",
            "updated_at": "2022-09-04T14:36:07.129627Z",
            "structure_string": "Ba3 Nb2 Co1 O9\n1.0\n5.821990 0.000000 0.000000\n-2.910995 5.041991 -0.000000\n-0.000000 0.000000 7.150482\nBa Nb Co O\n3 2 1 9\ndirect\n0.666667 0.333333 0.335765 Ba\n0.333332 0.666667 0.664235 Ba\n0.000000 0.000000 0.000000 Ba\n0.333332 0.666667 0.178608 Nb\n0.666667 0.333333 0.821391 Nb\n0.000000 0.000000 0.500000 Co\n0.339355 0.169677 0.671715 O\n0.830323 0.169677 0.671715 O\n0.830322 0.660645 0.671715 O\n0.169677 0.830323 0.328284 O\n0.660645 0.830323 0.328284 O\n0.169677 0.339355 0.328284 O\n0.500000 -0.000000 0.000000 O\n-0.000000 0.500000 0.000000 O\n0.500000 0.500000 0.000000 O\n",
            "nsites": 15,
            "nelements": 4,
            "elements": [
                "Ba",
                "Nb",
                "Co",
                "O"
            ],
            "chemical_system": "Ba-Co-Nb-O",
            "density": 6.334637656137759,
            "density_atomic": 0.07146319354805158,
            "volume": 209.8982602829533,
            "volume_molar": 8.426912458020414,
            "formula_full": "Ba3 Nb2 Co1 O9",
            "formula_reduced": "Ba3Nb2CoO9",
            "formula_anonymous": "AB2C3D9",
            "energy_above_hull": 2.730733940666666,
            "spacegroup": 164
        },
        {
            "id": "jvasp-86588",
            "created_at": "2022-09-04T14:35:59.738519Z",
            "updated_at": "2022-09-04T14:35:59.738543Z",
            "structure_string": "Ba3 Nb2 Co1 O9\n1.0\n5.822160 -0.000261 0.000411\n-2.910869 5.042230 0.002516\n-0.000801 -0.003887 7.150658\nBa Nb Co O\n3 2 1 9\ndirect\n0.666663 0.333332 0.335757 Ba\n-0.000000 0.000001 0.000000 Ba\n0.333336 0.666669 0.664243 Ba\n0.333335 0.666676 0.178605 Nb\n0.666665 0.333324 0.821396 Nb\n-0.000000 -0.000000 0.500000 Co\n0.500000 0.500000 0.000000 O\n0.169684 0.339381 0.328294 O\n0.830317 0.660618 0.671706 O\n-0.000000 0.499999 0.000000 O\n0.169693 0.830341 0.328264 O\n0.339342 0.169647 0.671721 O\n0.830308 0.169658 0.671737 O\n0.660658 0.830352 0.328279 O\n0.500000 0.000000 -0.000000 O\n",
            "nsites": 15,
            "nelements": 4,
            "elements": [
                "Ba",
                "Nb",
                "Co",
                "O"
            ],
            "chemical_system": "Ba-Co-Nb-O",
            "density": 6.334158554776176,
            "density_atomic": 0.071457788643274,
            "volume": 209.91413651046258,
            "volume_molar": 8.427549850532406,
            "formula_full": "Ba3 Nb2 Co1 O9",
            "formula_reduced": "Ba3Nb2CoO9",
            "formula_anonymous": "AB2C3D9",
            "energy_above_hull": 2.730737274,
            "spacegroup": 164
        },
        {
            "id": "jvasp-26131",
            "created_at": "2022-09-04T14:37:39.433581Z",
            "updated_at": "2022-09-04T14:37:39.433609Z",
            "structure_string": "Ba3 Nb2 O8\n1.0\n5.656122 0.013032 5.693233\n2.355726 5.142222 5.693233\n0.020253 0.013032 8.025223\nBa Nb O\n3 2 8\ndirect\n0.000000 0.000000 0.000000 Ba\n0.800285 0.800284 0.800285 Ba\n0.199715 0.199715 0.199715 Ba\n0.405952 0.405952 0.405952 Nb\n0.594048 0.594047 0.594048 Nb\n0.267186 0.267185 0.770896 O\n0.770896 0.267185 0.267186 O\n0.267186 0.770895 0.267185 O\n0.732814 0.732814 0.229104 O\n0.229105 0.732814 0.732814 O\n0.732814 0.229104 0.732814 O\n0.319588 0.319588 0.319588 O\n0.680412 0.680411 0.680411 O\n",
            "nsites": 13,
            "nelements": 3,
            "elements": [
                "Ba",
                "Nb",
                "O"
            ],
            "chemical_system": "Ba-Nb-O",
            "density": 5.18742546018862,
            "density_atomic": 0.05595459623452678,
            "volume": 232.33122700970094,
            "volume_molar": 10.76254886150718,
            "formula_full": "Ba3 Nb2 O8",
            "formula_reduced": "Ba3Nb2O8",
            "formula_anonymous": "A2B3C8",
            "energy_above_hull": 2.5576688238461536,
            "spacegroup": 166
        },
        {
            "id": "jvasp-10102",
            "created_at": "2022-09-04T14:37:51.143745Z",
            "updated_at": "2022-09-04T14:37:51.143765Z",
            "structure_string": "Ba3 Nb2 Zn1 O9\n1.0\n2.926576 -5.068977 0.000000\n2.926576 5.068977 -0.000000\n-0.000000 -0.000000 7.189856\nBa Nb Zn O\n3 2 1 9\ndirect\n0.666668 0.333334 0.335486 Ba\n0.333334 0.666668 0.664515 Ba\n0.000000 0.000000 0.000000 Ba\n0.333334 0.666668 0.177125 Nb\n0.666668 0.333334 0.822875 Nb\n0.000000 0.000000 0.500000 Zn\n0.828635 0.171367 0.674798 O\n0.828635 0.657268 0.674798 O\n0.342733 0.171367 0.674798 O\n0.657268 0.828635 0.325202 O\n0.171367 0.342733 0.325202 O\n0.171367 0.828635 0.325202 O\n0.500001 0.000000 0.000000 O\n0.000000 0.500001 0.000000 O\n0.500001 0.500001 0.000000 O\n",
            "nsites": 15,
            "nelements": 4,
            "elements": [
                "Ba",
                "Nb",
                "Zn",
                "O"
            ],
            "chemical_system": "Ba-Nb-O-Zn",
            "density": 6.28345508313881,
            "density_atomic": 0.07031709875056341,
            "volume": 213.31938129600113,
            "volume_molar": 8.564262273337533,
            "formula_full": "Ba3 Nb2 Zn1 O9",
            "formula_reduced": "Ba3Nb2ZnO9",
            "formula_anonymous": "AB2C3D9",
            "energy_above_hull": 2.321158574,
            "spacegroup": 164
        },
        {
            "id": "jvasp-88770",
            "created_at": "2022-09-04T14:35:54.079231Z",
            "updated_at": "2022-09-04T14:35:54.079245Z",
            "structure_string": "Ba3 Nb6 Si4 O26\n1.0\n9.143801 0.000000 -0.000000\n-4.571901 7.918764 0.000000\n-0.000000 0.000000 7.791585\nBa Nb Si O\n3 6 4 26\ndirect\n0.603233 0.000000 0.500000 Ba\n0.396767 0.396767 0.500000 Ba\n-0.000000 0.603233 0.500000 Ba\n0.239009 0.000000 0.242853 Nb\n0.760990 0.760990 0.757147 Nb\n-0.000000 0.239009 0.757147 Nb\n-0.000000 0.239009 0.242853 Nb\n0.760990 0.760990 0.242853 Nb\n0.239009 0.000000 0.757147 Nb\n0.666667 0.333333 0.208059 Si\n0.666667 0.333333 0.791940 Si\n0.333333 0.666667 0.208059 Si\n0.333333 0.666667 0.791940 Si\n0.695084 0.511366 0.711434 O\n0.488634 0.183718 0.288565 O\n0.821452 0.000000 0.775194 O\n0.178548 0.178548 0.224806 O\n-0.000000 0.821452 0.224806 O\n-0.000000 0.821452 0.775194 O\n-0.000000 0.221139 0.500000 O\n-0.000000 0.290782 0.000000 O\n0.778860 0.778860 0.500000 O\n0.221139 0.000000 0.500000 O\n0.511366 0.695084 0.288565 O\n0.304916 0.816282 0.288565 O\n0.183718 0.488633 0.288565 O\n0.488634 0.183718 0.711434 O\n0.183718 0.488633 0.711434 O\n0.821452 0.000000 0.224806 O\n0.511366 0.695084 0.711434 O\n0.695084 0.511366 0.288565 O\n0.816282 0.304916 0.288565 O\n0.816282 0.304916 0.711434 O\n0.333333 0.666667 0.000000 O\n0.666667 0.333333 0.000000 O\n0.290782 0.000000 0.000000 O\n0.709217 0.709217 0.000000 O\n0.304916 0.816282 0.711434 O\n0.178548 0.178548 0.775194 O\n",
            "nsites": 39,
            "nelements": 4,
            "elements": [
                "Ba",
                "Nb",
                "Si",
                "O"
            ],
            "chemical_system": "Ba-Nb-O-Si",
            "density": 4.408361434626216,
            "density_atomic": 0.06912810127340906,
            "volume": 564.1699870469581,
            "volume_molar": 8.711566857856818,
            "formula_full": "Ba3 Nb6 Si4 O26",
            "formula_reduced": "Ba3Nb6(Si2O13)2",
            "formula_anonymous": "A3B4C6D26",
            "energy_above_hull": 3.496494607948718,
            "spacegroup": 189
        }
    ]
}