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=-density&page=4192",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-density&page=4190",
"results": [
{
"id": "jvasp-40658",
"created_at": "2022-09-04T14:38:00.462394Z",
"updated_at": "2022-09-04T14:38:00.462419Z",
"structure_string": "Li8 V2 F12\n1.0\n0.000000 5.154006 0.676586\n8.865174 0.000000 0.000000\n0.000000 -2.467329 -5.430313\nLi V F\n8 2 12\ndirect\n0.244076 0.834191 0.895486 Li\n0.744076 0.665808 0.895486 Li\n0.069998 0.159912 0.593946 Li\n0.569998 0.340088 0.593946 Li\n0.430002 0.659912 0.406053 Li\n0.930002 0.840087 0.406053 Li\n0.255924 0.334191 0.104513 Li\n0.755924 0.165809 0.104513 Li\n0.500000 0.000000 0.499999 V\n-0.000000 0.500000 0.500000 V\n0.547159 0.176506 0.287974 F\n0.002361 0.668703 0.253217 F\n0.029058 0.013723 0.290249 F\n0.047159 0.323493 0.287975 F\n0.952841 0.676506 0.712024 F\n0.497639 0.168703 0.746782 F\n-0.002361 0.331297 0.746782 F\n0.452841 0.823493 0.712024 F\n0.470942 0.513723 0.709750 F\n0.529059 0.486277 0.290249 F\n0.970942 0.986276 0.709750 F\n0.502361 0.831297 0.253217 F\n",
"nsites": 22,
"nelements": 3,
"elements": [
"Li",
"V",
"F"
],
"chemical_system": "F-Li-V",
"density": 2.7428567216096167,
"density_atomic": 0.09429185771012849,
"volume": 233.318130899831,
"volume_molar": 6.386702846085854,
"formula_full": "Li8 V2 F12",
"formula_reduced": "Li4VF6",
"formula_anonymous": "AB4C6",
"energy_above_hull": 0.4186914450000001,
"spacegroup": 14
},
{
"id": "jvasp-47749",
"created_at": "2022-09-04T14:38:14.708386Z",
"updated_at": "2022-09-04T14:38:14.708409Z",
"structure_string": "Li4 Cr2 Si4 O12\n1.0\n2.990309 4.948446 0.075178\n-2.990309 4.948446 -0.075178\n-0.339505 0.000000 8.912985\nLi Cr Si O\n4 2 4 12\ndirect\n0.605408 0.690503 0.884928 Li\n0.309498 0.394593 0.384928 Li\n0.690502 0.605409 0.615073 Li\n0.394592 0.309498 0.115073 Li\n0.238859 0.238860 0.750000 Cr\n0.761141 0.761141 0.250000 Cr\n0.127246 0.793216 0.639443 Si\n0.206785 0.872754 0.139443 Si\n0.793215 0.127247 0.860557 Si\n0.872754 0.206785 0.360557 Si\n0.762705 0.508443 0.409043 O\n0.491557 0.237296 0.909043 O\n0.000000 0.000000 0.000000 O\n0.131232 0.131232 0.250000 O\n-0.000000 0.000000 0.500000 O\n0.351306 0.846443 0.723559 O\n0.508443 0.762705 0.090957 O\n0.237295 0.491558 0.590958 O\n0.153558 0.648694 0.223559 O\n0.846442 0.351307 0.776442 O\n0.868768 0.868769 0.750000 O\n0.648694 0.153558 0.276442 O\n",
"nsites": 22,
"nelements": 4,
"elements": [
"Li",
"Cr",
"Si",
"O"
],
"chemical_system": "Cr-Li-O-Si",
"density": 2.742663029154481,
"density_atomic": 0.08332377007081777,
"volume": 264.03029989283925,
"volume_molar": 7.2273983220895035,
"formula_full": "Li4 Cr2 Si4 O12",
"formula_reduced": "Li2Cr(SiO3)2",
"formula_anonymous": "AB2C2D6",
"energy_above_hull": 2.7396295999999998,
"spacegroup": 15
},
{
"id": "jvasp-49191",
"created_at": "2022-09-04T14:37:18.575286Z",
"updated_at": "2022-09-04T14:37:18.575311Z",
"structure_string": "Na3 Rh1 N6 O12\n1.0\n6.426259 -0.009824 2.037804\n1.488718 6.251449 2.037804\n-0.012457 -0.009824 6.741609\nNa Rh N O\n3 1 6 12\ndirect\n0.267438 0.267439 0.267438 Na\n0.732561 0.732563 0.732561 Na\n0.500000 0.500001 0.499999 Na\n0.000000 0.000000 0.000000 Rh\n0.203550 0.203551 0.825661 N\n0.796450 0.174340 0.796449 N\n0.825661 0.203551 0.203549 N\n0.174338 0.796451 0.796449 N\n0.796450 0.796451 0.174338 N\n0.203550 0.825662 0.203549 N\n0.912506 0.286401 0.286400 O\n0.087494 0.713600 0.713599 O\n0.713600 0.713600 0.087493 O\n0.713599 0.087495 0.713599 O\n0.243324 0.243325 0.625908 O\n0.625908 0.243325 0.243323 O\n0.374092 0.756677 0.756675 O\n0.756676 0.374093 0.756675 O\n0.756676 0.756677 0.374091 O\n0.286400 0.912506 0.286400 O\n0.286400 0.286401 0.912505 O\n0.243324 0.625909 0.243323 O\n",
"nsites": 22,
"nelements": 4,
"elements": [
"Na",
"Rh",
"N",
"O"
],
"chemical_system": "N-Na-O-Rh",
"density": 2.7426105771851303,
"density_atomic": 0.08112395152981779,
"volume": 271.1899455725319,
"volume_molar": 7.423381931520572,
"formula_full": "Na3 Rh1 N6 O12",
"formula_reduced": "Na3Rh(NO2)6",
"formula_anonymous": "AB3C6D12",
"energy_above_hull": 3.4663191590909093,
"spacegroup": 166
},
{
"id": "jvasp-60915",
"created_at": "2022-09-04T14:35:57.492777Z",
"updated_at": "2022-09-04T14:35:57.492793Z",
"structure_string": "Ca4 Mg1 B4 H6 C2 O18\n1.0\n4.304910 8.728761 -0.016549\n-4.304910 8.728761 -0.016549\n0.000000 0.899591 4.396837\nCa Mg B H C O\n4 1 4 6 2 18\ndirect\n0.075858 0.610900 0.145538 Ca\n0.389100 0.924142 0.854462 Ca\n0.924142 0.389100 0.854462 Ca\n0.610900 0.075858 0.145538 Ca\n0.000000 0.000000 0.000000 Mg\n0.228260 0.771740 0.500000 B\n0.771740 0.228260 0.500000 B\n0.901144 0.901144 0.614286 B\n0.098856 0.098856 0.385714 B\n0.218387 0.218387 0.318633 H\n0.781613 0.781613 0.681367 H\n0.593853 0.389748 0.211220 H\n0.610252 0.406147 0.788781 H\n0.406147 0.610252 0.788781 H\n0.389748 0.593853 0.211220 H\n0.309545 0.309545 0.746030 C\n0.690455 0.690455 0.253971 C\n0.179788 0.179788 0.186611 O\n0.820212 0.820212 0.813390 O\n0.418795 0.154909 0.649318 O\n0.845091 0.581204 0.350682 O\n0.581204 0.845091 0.350682 O\n0.154909 0.418795 0.649318 O\n0.628315 0.280548 0.326627 O\n0.719452 0.371685 0.673373 O\n0.897827 0.897827 0.303974 O\n0.280548 0.628315 0.326627 O\n0.805816 0.080806 0.718310 O\n0.919194 0.194183 0.281690 O\n0.194183 0.919194 0.281690 O\n0.080806 0.805816 0.718310 O\n0.102173 0.102173 0.696026 O\n0.647933 0.647933 0.048305 O\n0.371685 0.719452 0.673373 O\n0.352067 0.352067 0.951695 O\n",
"nsites": 35,
"nelements": 6,
"elements": [
"Ca",
"Mg",
"B",
"H",
"C",
"O"
],
"chemical_system": "B-C-Ca-H-Mg-O",
"density": 2.7423445957087433,
"density_atomic": 0.10587966840519628,
"volume": 330.56393665738284,
"volume_molar": 5.687721590658524,
"formula_full": "Ca4 Mg1 B4 H6 C2 O18",
"formula_reduced": "Ca4MgB4H6(CO9)2",
"formula_anonymous": "AB2C4D4E6F18",
"energy_above_hull": 3.119450116095238,
"spacegroup": 12
},
{
"id": "jvasp-55211",
"created_at": "2022-09-04T14:38:34.390141Z",
"updated_at": "2022-09-04T14:38:34.390154Z",
"structure_string": "Rb1 N3\n1.0\n3.709435 0.000000 -0.000000\n0.000000 3.709435 0.000000\n0.000000 0.000000 5.610367\nRb N\n1 3\ndirect\n0.500001 0.500001 0.500000 Rb\n0.000000 0.000000 0.211549 N\n0.000000 0.000000 0.788451 N\n0.000000 0.000000 0.000000 N\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Rb",
"N"
],
"chemical_system": "N-Rb",
"density": 2.7422766308581967,
"density_atomic": 0.05181472399998317,
"volume": 77.1981338740953,
"volume_molar": 11.62245071497815,
"formula_full": "Rb1 N3",
"formula_reduced": "RbN3",
"formula_anonymous": "AB3",
"energy_above_hull": 3.579702437500001,
"spacegroup": 123
},
{
"id": "jvasp-48627",
"created_at": "2022-09-04T14:37:07.045802Z",
"updated_at": "2022-09-04T14:37:07.045826Z",
"structure_string": "Li2 V2 F8\n1.0\n5.099994 0.078192 -0.006416\n-0.082971 5.392943 -0.076947\n-2.540383 -0.200148 5.899021\nLi V F\n2 2 8\ndirect\n0.001577 0.249991 0.500004 Li\n-0.001575 0.750009 0.499995 Li\n0.499997 0.500001 -0.000001 V\n-0.000001 -0.000001 0.000001 V\n0.775753 0.691010 0.928994 F\n0.050061 -0.009655 0.315177 F\n0.234853 0.509642 0.684832 F\n0.346750 0.808999 0.070988 F\n0.653247 0.190999 -0.070990 F\n0.765147 0.490357 0.315167 F\n0.949937 0.009655 0.684820 F\n0.224246 0.308991 0.071004 F\n",
"nsites": 12,
"nelements": 3,
"elements": [
"Li",
"V",
"F"
],
"chemical_system": "F-Li-V",
"density": 2.742264333810988,
"density_atomic": 0.07401306243354441,
"volume": 162.1335424510326,
"volume_molar": 8.136591787979615,
"formula_full": "Li2 V2 F8",
"formula_reduced": "LiVF4",
"formula_anonymous": "ABC4",
"energy_above_hull": 0.3185375549999999,
"spacegroup": 15
},
{
"id": "jvasp-67446",
"created_at": "2022-09-04T14:35:53.349941Z",
"updated_at": "2022-09-04T14:35:53.349966Z",
"structure_string": "Na1 Be1 Br1\n1.0\n1.807160 -3.130093 -0.000000\n1.807160 3.130093 -0.000000\n0.000000 -0.000000 5.989853\nNa Be Br\n1 1 1\ndirect\n0.333333 0.666667 0.684587 Na\n0.000000 0.000000 0.036435 Be\n0.666667 0.333333 0.278977 Br\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Na",
"Be",
"Br"
],
"chemical_system": "Be-Br-Na",
"density": 2.742219875950838,
"density_atomic": 0.04427119533321191,
"volume": 67.76415177905584,
"volume_molar": 13.602842016515954,
"formula_full": "Na1 Be1 Br1",
"formula_reduced": "NaBeBr",
"formula_anonymous": "ABC",
"energy_above_hull": 0.2789297349999999,
"spacegroup": 156
},
{
"id": "jvasp-88859",
"created_at": "2022-09-04T14:35:56.757765Z",
"updated_at": "2022-09-04T14:35:56.757786Z",
"structure_string": "Si5 P6 O25\n1.0\n7.159151 -0.002785 5.953484\n2.790560 6.592891 5.953484\n-0.004204 -0.002785 9.311142\nSi P O\n5 6 25\ndirect\n0.179672 0.179671 0.179672 Si\n0.000000 0.000000 0.000000 Si\n0.820329 0.820327 0.820328 Si\n0.433826 0.433824 0.433825 Si\n0.566176 0.566174 0.566175 Si\n0.927805 0.174163 0.621354 P\n0.825836 0.378644 0.072195 P\n0.072196 0.825835 0.378645 P\n0.621355 0.927804 0.174164 P\n0.378646 0.072195 0.825835 P\n0.174165 0.621354 0.927804 P\n0.250972 0.973750 0.897212 O\n0.432255 0.206146 0.590702 O\n0.026250 0.102787 0.749029 O\n0.102788 0.749029 0.026249 O\n0.749029 0.026249 0.102788 O\n0.973751 0.897211 0.250971 O\n0.897213 0.250970 0.973750 O\n0.096452 0.139730 0.428170 O\n0.733092 0.779314 0.076708 O\n0.139731 0.428170 0.096452 O\n0.428171 0.096451 0.139730 O\n0.903549 0.860268 0.571829 O\n0.860271 0.571828 0.903548 O\n0.571831 0.903547 0.860269 O\n0.793854 0.409297 0.567746 O\n0.076709 0.733091 0.779315 O\n0.409298 0.567745 0.793853 O\n0.206147 0.590702 0.432254 O\n0.590703 0.432253 0.206146 O\n0.500001 0.499999 0.500000 O\n0.266909 0.220684 0.923292 O\n0.923292 0.266907 0.220685 O\n0.220685 0.923291 0.266907 O\n0.567747 0.793853 0.409297 O\n0.779316 0.076707 0.733092 O\n",
"nsites": 36,
"nelements": 3,
"elements": [
"Si",
"P",
"O"
],
"chemical_system": "O-P-Si",
"density": 2.7421537181416236,
"density_atomic": 0.08185703721307262,
"volume": 439.79114350660586,
"volume_molar": 7.35690047555039,
"formula_full": "Si5 P6 O25",
"formula_reduced": "Si5P6O25",
"formula_anonymous": "A5B6C25",
"energy_above_hull": 3.3018248194444446,
"spacegroup": 148
},
{
"id": "jvasp-42233",
"created_at": "2022-09-04T14:36:01.511084Z",
"updated_at": "2022-09-04T14:36:01.511110Z",
"structure_string": "Li2 V2 F8\n1.0\n-5.097874 0.000894 -0.001147\n-0.000944 -5.394630 -0.001529\n2.547779 0.245694 5.896420\nLi V F\n2 2 8\ndirect\n-0.001445 0.248245 0.999023 Li\n0.001359 0.748241 0.999024 Li\n0.499979 0.998266 0.499010 V\n-0.000016 0.498263 0.499028 V\n0.234674 0.007884 0.183996 F\n0.653091 0.689228 0.427892 F\n0.775732 0.189226 0.427878 F\n0.049700 0.488620 0.814041 F\n0.950264 0.507874 0.184010 F\n0.224210 0.807308 0.570143 F\n0.346873 0.307305 0.570159 F\n0.765267 0.988610 0.814023 F\n",
"nsites": 12,
"nelements": 3,
"elements": [
"Li",
"V",
"F"
],
"chemical_system": "F-Li-V",
"density": 2.7421446739935176,
"density_atomic": 0.07400983284351836,
"volume": 162.14061752270175,
"volume_molar": 8.136946846958605,
"formula_full": "Li2 V2 F8",
"formula_reduced": "LiVF4",
"formula_anonymous": "ABC4",
"energy_above_hull": 0.3184742216666666,
"spacegroup": 15
},
{
"id": "jvasp-59092",
"created_at": "2022-09-04T14:38:36.675826Z",
"updated_at": "2022-09-04T14:38:36.675854Z",
"structure_string": "Rb4 Ga4 Cl16\n1.0\n7.028187 0.000000 0.000000\n-0.000000 9.261600 0.000000\n0.000000 0.000000 11.053057\nRb Ga Cl\n4 4 16\ndirect\n0.750000 0.819842 0.682749 Rb\n0.250000 0.180158 0.317251 Rb\n0.250000 0.319842 0.817251 Rb\n0.750000 0.680158 0.182749 Rb\n0.250000 0.810475 0.931827 Ga\n0.750000 0.189525 0.068174 Ga\n0.750000 0.310475 0.568174 Ga\n0.250000 0.689525 0.431826 Ga\n-0.001786 0.830740 0.422941 Cl\n0.498214 0.169260 0.577059 Cl\n-0.001786 0.669260 0.922941 Cl\n0.498214 0.330740 0.077059 Cl\n0.001786 0.169260 0.577059 Cl\n0.501786 0.830740 0.422941 Cl\n0.250000 0.550974 0.270769 Cl\n0.250000 0.568315 0.602325 Cl\n0.750000 0.050974 0.229231 Cl\n0.250000 0.949026 0.770769 Cl\n0.501786 0.669260 0.922941 Cl\n0.750000 0.431685 0.397675 Cl\n0.750000 0.068315 0.897675 Cl\n0.250000 0.931685 0.102325 Cl\n0.750000 0.449026 0.729231 Cl\n0.001786 0.330740 0.077059 Cl\n",
"nsites": 24,
"nelements": 3,
"elements": [
"Rb",
"Ga",
"Cl"
],
"chemical_system": "Cl-Ga-Rb",
"density": 2.7419396654059076,
"density_atomic": 0.03335796152670883,
"volume": 719.4684237759506,
"volume_molar": 18.05308383480877,
"formula_full": "Rb4 Ga4 Cl16",
"formula_reduced": "RbGaCl4",
"formula_anonymous": "ABC4",
"energy_above_hull": 0.0,
"spacegroup": 62
},
{
"id": "jvasp-118812",
"created_at": "2022-09-04T14:38:48.716347Z",
"updated_at": "2022-09-04T14:38:48.716371Z",
"structure_string": "Na1 Zn1\n1.0\n4.203716 0.000000 0.000000\n0.000000 4.203716 -0.000000\n0.000000 -0.000000 3.029508\nNa Zn\n1 1\ndirect\n0.000000 0.000000 0.000000 Na\n0.500000 0.500000 0.000000 Zn\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Na",
"Zn"
],
"chemical_system": "Na-Zn",
"density": 2.7419307178215817,
"density_atomic": 0.03735864849044129,
"volume": 53.53512722794902,
"volume_molar": 16.119803588560877,
"formula_full": "Na1 Zn1",
"formula_reduced": "NaZn",
"formula_anonymous": "AB",
"energy_above_hull": 0.5989760526315789,
"spacegroup": 123
},
{
"id": "jvasp-115416",
"created_at": "2022-09-04T14:38:45.782415Z",
"updated_at": "2022-09-04T14:38:45.782439Z",
"structure_string": "Na1 Li1 As1\n1.0\n4.851444 0.000000 -0.000000\n-2.425722 4.201474 0.000000\n-0.000000 -0.000000 3.115589\nNa Li As\n1 1 1\ndirect\n0.666666 0.333333 0.000000 Na\n0.333333 0.666665 0.000000 Li\n0.000000 0.000000 0.000000 As\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Na",
"Li",
"As"
],
"chemical_system": "As-Li-Na",
"density": 2.741665587538073,
"density_atomic": 0.047239836936686486,
"volume": 63.505723019763394,
"volume_molar": 12.748013436352915,
"formula_full": "Na1 Li1 As1",
"formula_reduced": "NaLiAs",
"formula_anonymous": "ABC",
"energy_above_hull": 0.5594902499999999,
"spacegroup": 187
}
]
}