GET /third-parties/JarvisStructure/?format=api&ordering=formula_anonymous&page=4391
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=4392",
    "previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=formula_anonymous&page=4390",
    "results": [
        {
            "id": "jvasp-55459",
            "created_at": "2022-09-04T14:38:16.268982Z",
            "updated_at": "2022-09-04T14:38:16.269006Z",
            "structure_string": "Nd8 Mn2 Se12 O2\n1.0\n4.791573 -8.299247 0.000000\n4.791573 8.299247 -0.000000\n-0.000000 -0.000000 6.893511\nNd Mn Se O\n8 2 12 2\ndirect\n0.333333 0.666667 0.294615 Nd\n0.666667 0.333333 0.794614 Nd\n0.801797 0.198203 0.342424 Nd\n0.603595 0.801797 0.842424 Nd\n0.198203 0.396405 0.842424 Nd\n0.801797 0.603595 0.342424 Nd\n0.396405 0.198203 0.342424 Nd\n0.198203 0.801797 0.842424 Nd\n0.000000 0.000000 0.494655 Mn\n0.000000 0.000000 -0.005345 Mn\n0.115669 0.884330 0.236395 Se\n0.231340 0.115670 0.736395 Se\n0.884330 0.768659 0.736395 Se\n0.115670 0.231340 0.236395 Se\n0.768659 0.884330 0.236395 Se\n0.884330 0.115669 0.736395 Se\n0.529102 0.058205 0.052097 Se\n0.058205 0.529102 0.552097 Se\n0.470898 0.529102 0.552097 Se\n0.941795 0.470898 0.052097 Se\n0.470898 0.941795 0.552097 Se\n0.529102 0.470898 0.052097 Se\n0.333333 0.666667 0.959822 O\n0.666667 0.333333 0.459822 O\n",
            "nsites": 24,
            "nelements": 4,
            "elements": [
                "Nd",
                "Mn",
                "Se",
                "O"
            ],
            "chemical_system": "Mn-Nd-O-Se",
            "density": 6.79446344105834,
            "density_atomic": 0.04377478018308827,
            "volume": 548.2608913081884,
            "volume_molar": 13.757101086087383,
            "formula_full": "Nd8 Mn2 Se12 O2",
            "formula_reduced": "Nd4MnSe6O",
            "formula_anonymous": "ABC4D6",
            "energy_above_hull": 2.0366797451149425,
            "spacegroup": 186
        },
        {
            "id": "jvasp-52255",
            "created_at": "2022-09-04T14:38:04.842883Z",
            "updated_at": "2022-09-04T14:38:04.842907Z",
            "structure_string": "Ca2 H8 S2 O12\n1.0\n5.640635 0.000000 0.110188\n-2.820318 7.659719 -0.055094\n2.673788 0.000000 5.747731\nCa H S O\n2 8 2 12\ndirect\n0.324520 0.149042 0.250000 Ca\n0.675478 0.850958 0.750001 Ca\n0.099787 0.655473 0.029609 H\n0.055687 0.655473 0.470392 H\n0.244640 0.493075 0.474298 H\n0.251566 0.506925 0.974298 H\n0.748432 0.493075 0.025703 H\n0.755358 0.506925 0.525703 H\n0.944312 0.344527 0.529609 H\n0.900212 0.344527 0.970392 H\n0.330973 0.161946 0.750000 S\n0.669026 0.838054 0.250001 S\n0.421320 0.049318 0.844075 O\n0.145732 0.367208 0.472235 O\n0.578678 0.950682 0.155926 O\n0.429757 0.730046 0.448737 O\n0.278524 0.632792 0.972235 O\n0.127998 0.049318 0.655925 O\n0.800286 0.730046 0.051264 O\n0.199713 0.269954 0.948737 O\n0.872000 0.950682 0.344076 O\n0.721475 0.367208 0.027766 O\n0.570241 0.269954 0.551263 O\n0.854267 0.632792 0.527766 O\n",
            "nsites": 24,
            "nelements": 4,
            "elements": [
                "Ca",
                "H",
                "S",
                "O"
            ],
            "chemical_system": "Ca-H-O-S",
            "density": 2.3236293431398685,
            "density_atomic": 0.09753008331911375,
            "volume": 246.07791958377757,
            "volume_molar": 6.174649456922788,
            "formula_full": "Ca2 H8 S2 O12",
            "formula_reduced": "CaH4SO6",
            "formula_anonymous": "ABC4D6",
            "energy_above_hull": 2.527937618333333,
            "spacegroup": 15
        },
        {
            "id": "jvasp-12487",
            "created_at": "2022-09-04T14:38:05.173024Z",
            "updated_at": "2022-09-04T14:38:05.173049Z",
            "structure_string": "K1 As4 Br1 O6\n1.0\n2.666952 -4.619296 -0.000000\n2.666952 4.619296 -0.000000\n0.000000 0.000000 8.870165\nK As Br O\n1 4 1 6\ndirect\n0.000000 0.000000 0.500000 K\n0.333332 0.666667 0.791651 As\n0.666667 0.333332 0.791651 As\n0.666667 0.333332 0.208348 As\n0.333332 0.666667 0.208348 As\n0.000000 0.000000 0.000000 Br\n0.500000 0.500000 0.320667 O\n-0.000000 0.500000 0.679332 O\n0.500000 0.500000 0.679332 O\n0.500000 -0.000000 0.679332 O\n-0.000000 0.500000 0.320667 O\n0.500000 -0.000000 0.320667 O\n",
            "nsites": 12,
            "nelements": 4,
            "elements": [
                "K",
                "As",
                "Br",
                "O"
            ],
            "chemical_system": "As-Br-K-O",
            "density": 3.910551479295864,
            "density_atomic": 0.054907106809233684,
            "volume": 218.550943536183,
            "volume_molar": 10.967871210047553,
            "formula_full": "K1 As4 Br1 O6",
            "formula_reduced": "KAs4BrO6",
            "formula_anonymous": "ABC4D6",
            "energy_above_hull": 2.19431000875,
            "spacegroup": 191
        },
        {
            "id": "jvasp-12496",
            "created_at": "2022-09-04T14:38:15.991890Z",
            "updated_at": "2022-09-04T14:38:15.991906Z",
            "structure_string": "K1 As4 I1 O6\n1.0\n2.679262 -4.640619 -0.000000\n2.679262 4.640619 -0.000000\n0.000000 0.000000 9.081316\nK As I O\n1 4 1 6\ndirect\n0.000000 0.000000 0.500000 K\n0.333333 0.666667 0.784495 As\n0.666667 0.333333 0.784495 As\n0.666667 0.333333 0.215506 As\n0.333333 0.666667 0.215506 As\n0.000000 0.000000 0.000000 I\n0.500000 0.500000 0.325031 O\n-0.000000 0.500000 0.674970 O\n0.500000 0.500000 0.674970 O\n0.500000 -0.000000 0.674970 O\n-0.000000 0.500000 0.325031 O\n0.500000 -0.000000 0.325031 O\n",
            "nsites": 12,
            "nelements": 4,
            "elements": [
                "K",
                "As",
                "I",
                "O"
            ],
            "chemical_system": "As-I-K-O",
            "density": 4.130213313244167,
            "density_atomic": 0.05313875366200594,
            "volume": 225.82388883877732,
            "volume_molar": 11.332860379647583,
            "formula_full": "K1 As4 I1 O6",
            "formula_reduced": "KAs4IO6",
            "formula_anonymous": "ABC4D6",
            "energy_above_hull": 2.17327435625,
            "spacegroup": 191
        },
        {
            "id": "jvasp-122067",
            "created_at": "2022-09-04T14:38:52.674889Z",
            "updated_at": "2022-09-04T14:38:52.674917Z",
            "structure_string": "Tl8 Cu2 Te2 O12\n1.0\n5.750879 0.055614 1.706718\n0.552734 8.103026 3.394754\n-0.004599 0.031457 9.249604\nTl Cu Te O\n8 2 2 12\ndirect\n0.919960 0.110293 0.797741 Tl\n0.080039 0.889707 0.202259 Tl\n0.873882 0.254073 0.345412 Tl\n0.126118 0.745928 0.654588 Tl\n0.273080 0.390073 0.465863 Tl\n0.726919 0.609927 0.534136 Tl\n0.509285 0.923939 0.763050 Tl\n0.490714 0.076062 0.236950 Tl\n0.776065 0.444511 0.944281 Cu\n0.223935 0.555489 0.055718 Cu\n0.658711 0.668342 0.135487 Te\n0.341288 0.331658 0.864512 Te\n0.631126 0.256300 0.953457 O\n0.270321 0.108234 0.920510 O\n0.729678 0.891766 0.079489 O\n0.536944 0.347283 0.652413 O\n0.463055 0.652717 0.347586 O\n0.837126 0.665973 0.920070 O\n0.162873 0.334028 0.079929 O\n0.937794 0.574612 0.228585 O\n0.062205 0.425388 0.771414 O\n0.402553 0.560158 0.833286 O\n0.597446 0.439842 0.166714 O\n0.368874 0.743700 0.046543 O\n",
            "nsites": 24,
            "nelements": 4,
            "elements": [
                "Tl",
                "Cu",
                "Te",
                "O"
            ],
            "chemical_system": "Cu-O-Te-Tl",
            "density": 8.527508743536163,
            "density_atomic": 0.0557852727118647,
            "volume": 430.2210750848504,
            "volume_molar": 10.795216133664576,
            "formula_full": "Tl8 Cu2 Te2 O12",
            "formula_reduced": "Tl4CuTeO6",
            "formula_anonymous": "ABC4D6",
            "energy_above_hull": null,
            "spacegroup": 2
        },
        {
            "id": "jvasp-32398",
            "created_at": "2022-09-04T14:36:33.212268Z",
            "updated_at": "2022-09-04T14:36:33.212289Z",
            "structure_string": "B4 C1 Cl6 O1\n1.0\n6.415617 0.017432 -2.002305\n-2.727162 5.807149 -2.002305\n0.011040 0.017433 6.720808\nB C Cl O\n4 1 6 1\ndirect\n0.059076 0.320676 0.320676 B\n0.320676 0.320676 0.059077 B\n0.303012 0.303011 0.303012 B\n0.320676 0.059076 0.320676 B\n0.504691 0.504690 0.504691 C\n0.073050 0.546892 0.546892 Cl\n0.785554 0.114302 0.114303 Cl\n0.114303 0.114302 0.785554 Cl\n0.114302 0.785553 0.114302 Cl\n0.546892 0.073049 0.546892 Cl\n0.546893 0.546893 0.073051 Cl\n0.658578 0.658577 0.658578 O\n",
            "nsites": 12,
            "nelements": 4,
            "elements": [
                "B",
                "C",
                "Cl",
                "O"
            ],
            "chemical_system": "B-C-Cl-O",
            "density": 1.8774753068783825,
            "density_atomic": 0.047778301778321486,
            "volume": 251.16003611172252,
            "volume_molar": 12.604342422928967,
            "formula_full": "B4 C1 Cl6 O1",
            "formula_reduced": "B4CCl6O",
            "formula_anonymous": "ABC4D6",
            "energy_above_hull": 2.6819373531944444,
            "spacegroup": 160
        },
        {
            "id": "jvasp-59598",
            "created_at": "2022-09-04T14:37:11.485082Z",
            "updated_at": "2022-09-04T14:37:11.485100Z",
            "structure_string": "Sm8 Fe2 Se12 O2\n1.0\n4.747208 -8.222404 -0.000000\n4.747208 8.222404 0.000000\n-0.000000 -0.000000 6.916233\nSm Fe Se O\n8 2 12 2\ndirect\n0.666667 0.333333 0.709709 Sm\n0.333333 0.666667 0.209709 Sm\n0.200044 0.799957 0.659174 Sm\n0.400088 0.200043 0.159175 Sm\n0.799957 0.599913 0.159175 Sm\n0.200043 0.400088 0.659174 Sm\n0.599913 0.799957 0.659174 Sm\n0.799957 0.200044 0.159175 Sm\n0.000000 0.000000 0.492830 Fe\n0.000000 0.000000 0.992830 Fe\n0.875200 0.750400 0.765775 Se\n0.750400 0.875200 0.265775 Se\n0.124800 0.249600 0.265775 Se\n0.875200 0.124801 0.765775 Se\n0.249600 0.124800 0.765775 Se\n0.124801 0.875200 0.265775 Se\n0.469292 0.938585 0.947284 Se\n0.938585 0.469292 0.447285 Se\n0.530708 0.061415 0.447285 Se\n0.061415 0.530708 0.947284 Se\n0.530708 0.469292 0.447285 Se\n0.469292 0.530708 0.947284 Se\n0.666667 0.333333 0.043119 O\n0.333333 0.666667 0.543118 O\n",
            "nsites": 24,
            "nelements": 4,
            "elements": [
                "Sm",
                "Fe",
                "Se",
                "O"
            ],
            "chemical_system": "Fe-O-Se-Sm",
            "density": 7.05541620495865,
            "density_atomic": 0.04445028581770247,
            "volume": 539.929036641693,
            "volume_molar": 13.548036079447803,
            "formula_full": "Sm8 Fe2 Se12 O2",
            "formula_reduced": "Sm4FeSe6O",
            "formula_anonymous": "ABC4D6",
            "energy_above_hull": 1.906962058333333,
            "spacegroup": 186
        },
        {
            "id": "jvasp-25831",
            "created_at": "2022-09-04T14:38:29.632361Z",
            "updated_at": "2022-09-04T14:38:29.632384Z",
            "structure_string": "K1 As4 Cl1 O6\n1.0\n2.659766 -4.606850 0.000000\n2.659766 4.606850 0.000000\n0.000000 -0.000000 8.796992\nK As Cl O\n1 4 1 6\ndirect\n0.000000 0.000000 0.500000 K\n0.666668 0.333334 0.794331 As\n0.333334 0.666668 0.794331 As\n0.333334 0.666668 0.205669 As\n0.666668 0.333334 0.205669 As\n0.000000 0.000000 0.000000 Cl\n0.500001 0.500001 0.680968 O\n0.500001 0.500001 0.319032 O\n0.000000 0.500000 0.680968 O\n0.500000 0.000000 0.680968 O\n0.000000 0.500000 0.319032 O\n0.500000 0.000000 0.319032 O\n",
            "nsites": 12,
            "nelements": 4,
            "elements": [
                "K",
                "As",
                "Cl",
                "O"
            ],
            "chemical_system": "As-Cl-K-O",
            "density": 3.6220256591029423,
            "density_atomic": 0.055663377104265915,
            "volume": 215.5816018406894,
            "volume_molar": 10.818856262924223,
            "formula_full": "K1 As4 Cl1 O6",
            "formula_reduced": "KAs4ClO6",
            "formula_anonymous": "ABC4D6",
            "energy_above_hull": 2.211507505625,
            "spacegroup": 191
        },
        {
            "id": "jvasp-52957",
            "created_at": "2022-09-04T14:37:05.313097Z",
            "updated_at": "2022-09-04T14:37:05.313115Z",
            "structure_string": "As2 H12 N2 O8\n1.0\n-3.823232 3.823232 3.877755\n3.823232 -3.823232 3.877755\n3.823232 3.823232 -3.877755\nAs H N O\n2 12 2 8\ndirect\n0.749999 0.250000 0.500000 As\n0.000000 0.000000 0.000000 As\n0.874999 0.966420 0.591420 H\n0.375000 0.283579 0.408579 H\n0.716420 0.125000 0.091420 H\n0.594384 0.686567 0.130075 H\n0.193506 0.563432 0.407816 H\n0.033580 0.625000 0.908579 H\n0.155615 0.785689 0.592183 H\n0.535689 0.405615 0.092184 H\n0.436568 0.844384 0.630075 H\n0.313432 0.443506 0.907816 H\n0.214310 0.806494 0.369925 H\n0.556494 0.464310 0.869925 H\n0.250000 0.749999 0.500000 N\n0.499999 0.499999 0.000000 N\n0.717328 0.962904 0.428148 O\n0.710818 0.282671 0.245577 O\n0.712905 0.967328 0.928147 O\n0.037095 0.465241 0.754422 O\n0.039181 0.784758 0.071852 O\n0.534758 0.289181 0.571852 O\n0.032671 0.960818 0.745577 O\n0.215241 0.287094 0.254422 O\n",
            "nsites": 24,
            "nelements": 4,
            "elements": [
                "As",
                "H",
                "N",
                "O"
            ],
            "chemical_system": "As-H-N-O",
            "density": 2.328639582665734,
            "density_atomic": 0.10585456184192836,
            "volume": 226.72617582451457,
            "volume_molar": 5.6890706032989,
            "formula_full": "As2 H12 N2 O8",
            "formula_reduced": "AsH6NO4",
            "formula_anonymous": "ABC4D6",
            "energy_above_hull": 3.236884916666667,
            "spacegroup": 122
        },
        {
            "id": "jvasp-113122",
            "created_at": "2022-09-04T14:38:45.172625Z",
            "updated_at": "2022-09-04T14:38:45.172650Z",
            "structure_string": "Ba4 In1 Bi1 O6\n1.0\n4.514174 -0.000000 0.000000\n0.000000 4.514174 0.000000\n-0.000000 -0.000000 13.268069\nBa In Bi O\n4 1 1 6\ndirect\n0.000000 0.000000 0.360511 Ba\n0.500000 0.500000 0.870499 Ba\n0.500000 0.500000 0.129501 Ba\n0.000000 0.000000 0.639489 Ba\n0.000000 0.000000 0.000000 In\n0.500000 0.500000 0.500000 Bi\n0.500000 0.000000 -0.000000 O\n-0.000000 0.500000 0.500000 O\n-0.000000 0.500000 -0.000000 O\n0.500000 0.000000 0.500000 O\n0.500000 0.500000 0.682994 O\n0.500000 0.500000 0.317006 O\n",
            "nsites": 12,
            "nelements": 4,
            "elements": [
                "Ba",
                "In",
                "Bi",
                "O"
            ],
            "chemical_system": "Ba-Bi-In-O",
            "density": 5.951886411369838,
            "density_atomic": 0.04438302863537743,
            "volume": 270.3736173253142,
            "volume_molar": 13.568566511028473,
            "formula_full": "Ba4 In1 Bi1 O6",
            "formula_reduced": "Ba4InBiO6",
            "formula_anonymous": "ABC4D6",
            "energy_above_hull": 1.2428332625,
            "spacegroup": 123
        },
        {
            "id": "jvasp-33370",
            "created_at": "2022-09-04T14:37:52.832490Z",
            "updated_at": "2022-09-04T14:37:52.832525Z",
            "structure_string": "Cu2 Si2 H16 O8 F12\n1.0\n6.566126 0.069512 0.000000\n-2.169442 5.883782 0.000000\n0.000000 0.000000 9.311457\nCu Si H O F\n2 2 16 8 12\ndirect\n0.000000 0.500000 0.500000 Cu\n0.000000 0.000000 0.000000 Cu\n0.500000 0.500000 0.000000 Si\n0.500000 -0.000000 0.500000 Si\n0.245001 0.295121 0.599394 H\n0.245001 0.795121 0.900607 H\n0.755000 0.704878 0.400606 H\n0.319739 0.558546 0.654307 H\n0.680261 0.941453 0.154306 H\n0.680261 0.441453 0.345694 H\n0.319739 0.058546 0.845694 H\n0.755000 0.204878 0.099394 H\n0.964077 0.213252 0.288645 H\n0.964077 0.713252 0.211355 H\n0.035924 0.786747 0.711356 H\n0.201664 0.894149 0.213662 H\n0.798336 0.605850 0.713662 H\n0.798336 0.105850 0.786339 H\n0.201664 0.394149 0.286339 H\n0.035923 0.286747 0.788645 H\n0.192536 0.418670 0.636097 O\n0.807464 0.081329 0.136097 O\n0.192536 0.918670 0.863903 O\n0.807464 0.581329 0.363903 O\n0.919821 0.684117 0.649726 O\n0.919821 0.184117 0.850274 O\n0.080180 0.315882 0.350274 O\n0.080180 0.815882 0.149726 O\n0.686415 0.213889 0.593165 F\n0.707092 0.930111 0.424075 F\n0.292908 0.569888 0.924075 F\n0.292908 0.069888 0.575925 F\n0.707092 0.430111 0.075925 F\n0.509912 0.181114 0.358706 F\n0.490088 0.318885 0.858706 F\n0.490088 0.818885 0.641295 F\n0.509912 0.681114 0.141294 F\n0.313586 0.786110 0.406835 F\n0.686415 0.713889 0.906835 F\n0.313586 0.286110 0.093165 F\n",
            "nsites": 40,
            "nelements": 5,
            "elements": [
                "Cu",
                "Si",
                "H",
                "O",
                "F"
            ],
            "chemical_system": "Cu-F-H-O-Si",
            "density": 2.553601344190086,
            "density_atomic": 0.11076043239267647,
            "volume": 361.1397963686969,
            "volume_molar": 5.437086719425074,
            "formula_full": "Cu2 Si2 H16 O8 F12",
            "formula_reduced": "CuSiH8(O2F3)2",
            "formula_anonymous": "ABC4D6E8",
            "energy_above_hull": 1.94135423725,
            "spacegroup": 14
        },
        {
            "id": "jvasp-112220",
            "created_at": "2022-09-04T14:38:42.130489Z",
            "updated_at": "2022-09-04T14:38:42.130521Z",
            "structure_string": "H8 Pb1 C6 S1 O4\n1.0\n4.288427 0.037627 0.319547\n2.096558 4.632684 0.142486\n-0.091975 0.042321 10.161175\nH Pb C S O\n8 1 6 1 4\ndirect\n0.094630 0.616348 0.307750 H\n0.743430 0.599694 0.401963 H\n0.514731 0.196201 0.425300 H\n0.266963 0.496484 0.528357 H\n0.691825 0.197582 0.732994 H\n0.642020 0.497338 0.629642 H\n0.062031 0.600434 0.756275 H\n0.694087 0.617096 0.850360 H\n0.734801 0.932494 0.079155 Pb\n0.153905 0.260495 0.898288 C\n0.933050 0.467017 0.796696 C\n0.823249 0.325692 0.689580 C\n0.989921 0.259829 0.260102 C\n0.005238 0.466282 0.361557 C\n0.255947 0.324905 0.468698 C\n0.164383 0.074441 0.579359 S\n0.156257 0.010328 0.915105 O\n0.236847 0.009744 0.243300 O\n0.331845 0.349375 0.966654 O\n0.723274 0.348761 0.191789 O\n",
            "nsites": 20,
            "nelements": 5,
            "elements": [
                "H",
                "Pb",
                "C",
                "S",
                "O"
            ],
            "chemical_system": "C-H-O-Pb-S",
            "density": 3.1640637679247106,
            "density_atomic": 0.09939967910845214,
            "volume": 201.20789301722567,
            "volume_molar": 6.058511268863771,
            "formula_full": "H8 Pb1 C6 S1 O4",
            "formula_reduced": "H8PbC6SO4",
            "formula_anonymous": "ABC4D6E8",
            "energy_above_hull": 4.308629241,
            "spacegroup": 5
        }
    ]
}