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=1286",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=formula_anonymous&page=1284",
"results": [
{
"id": "jvasp-111348",
"created_at": "2022-09-04T14:38:52.118213Z",
"updated_at": "2022-09-04T14:38:52.118232Z",
"structure_string": "Na1 Bi3 Cl2 O4\n1.0\n6.681221 0.032744 0.000000\n-4.398459 5.029248 0.000000\n0.000000 -0.000000 5.543287\nNa Bi Cl O\n1 3 2 4\ndirect\n0.350464 0.649535 0.500000 Na\n0.845012 0.154987 -0.000000 Bi\n0.157098 0.842902 -0.000000 Bi\n0.655780 0.344219 0.500000 Bi\n0.494232 0.505768 -0.000000 Cl\n0.003297 0.996704 0.500000 Cl\n0.505206 0.008148 0.755670 O\n0.991852 0.494793 0.244330 O\n0.991852 0.494793 0.755670 O\n0.505206 0.008148 0.244330 O\n",
"nsites": 10,
"nelements": 4,
"elements": [
"Na",
"Bi",
"Cl",
"O"
],
"chemical_system": "Bi-Cl-Na-O",
"density": 6.966962428136843,
"density_atomic": 0.05345843578839886,
"volume": 187.06121592450566,
"volume_molar": 11.265089730341266,
"formula_full": "Na1 Bi3 Cl2 O4",
"formula_reduced": "NaBi3(ClO2)2",
"formula_anonymous": "AB2C3D4",
"energy_above_hull": 1.2666764035000002,
"spacegroup": 38
},
{
"id": "jvasp-105538",
"created_at": "2022-09-04T14:38:46.542577Z",
"updated_at": "2022-09-04T14:38:46.542605Z",
"structure_string": "Ce2 Al3 Ga1 Pd4\n1.0\n4.360452 -0.000000 0.000000\n0.000000 4.360452 0.000000\n0.000000 0.000000 10.137842\nCe Al Ga Pd\n2 3 1 4\ndirect\n0.500000 0.000000 0.251361 Ce\n-0.000000 0.500000 0.748639 Ce\n0.000000 0.000000 0.500000 Al\n0.500000 0.000000 0.876951 Al\n-0.000000 0.500000 0.123049 Al\n0.500000 0.500000 0.500000 Ga\n0.500000 0.500000 -0.000000 Pd\n0.000000 0.000000 0.000000 Pd\n0.500000 0.000000 0.633112 Pd\n-0.000000 0.500000 0.366887 Pd\n",
"nsites": 10,
"nelements": 4,
"elements": [
"Ce",
"Al",
"Ga",
"Pd"
],
"chemical_system": "Al-Ce-Ga-Pd",
"density": 7.379183225253233,
"density_atomic": 0.051878983893586535,
"volume": 192.75628105037416,
"volume_molar": 11.608054568594738,
"formula_full": "Ce2 Al3 Ga1 Pd4",
"formula_reduced": "Ce2Al3GaPd4",
"formula_anonymous": "AB2C3D4",
"energy_above_hull": 1.7910604525,
"spacegroup": 115
},
{
"id": "jvasp-111349",
"created_at": "2022-09-04T14:38:49.823063Z",
"updated_at": "2022-09-04T14:38:49.823081Z",
"structure_string": "Na1 Bi3 Br2 O4\n1.0\n6.904504 0.030005 0.000000\n-4.645629 5.107955 0.000000\n-0.000000 -0.000000 5.604284\nNa Bi Br O\n1 3 2 4\ndirect\n0.344881 0.655117 0.500000 Na\n0.840743 0.159255 -0.000000 Bi\n0.161622 0.838377 -0.000000 Bi\n0.660554 0.339444 0.500000 Bi\n0.494601 0.505397 -0.000000 Br\n0.003002 0.996997 0.500000 Br\n0.505776 0.008479 0.756400 O\n0.991519 0.494222 0.243600 O\n0.991519 0.494222 0.756400 O\n0.505776 0.008479 0.243600 O\n",
"nsites": 10,
"nelements": 4,
"elements": [
"Na",
"Bi",
"Br",
"O"
],
"chemical_system": "Bi-Br-Na-O",
"density": 7.311673902536597,
"density_atomic": 0.050394971431486246,
"volume": 198.43249665485683,
"volume_molar": 11.94988426213777,
"formula_full": "Na1 Bi3 Br2 O4",
"formula_reduced": "NaBi3(BrO2)2",
"formula_anonymous": "AB2C3D4",
"energy_above_hull": 1.2293884110000004,
"spacegroup": 38
},
{
"id": "jvasp-33317",
"created_at": "2022-09-04T14:36:48.720818Z",
"updated_at": "2022-09-04T14:36:48.720839Z",
"structure_string": "B4 H16 O8 F12\n1.0\n5.450083 0.000000 0.046970\n0.000000 7.260109 0.000000\n0.116340 0.000000 8.595550\nB H O F\n4 16 8 12\ndirect\n0.263625 0.305807 0.918625 B\n0.736375 0.805807 0.581375 B\n0.736375 0.694193 0.081375 B\n0.263625 0.194193 0.418625 B\n0.168277 0.936673 0.840873 H\n0.168277 0.563327 0.340873 H\n0.831722 0.063327 0.159127 H\n0.910783 0.225683 0.657817 H\n0.089217 0.725683 0.842183 H\n0.089217 0.774318 0.342183 H\n0.910783 0.274317 0.157817 H\n0.831722 0.436673 0.659127 H\n0.374845 0.739290 0.181773 H\n0.374845 0.760710 0.681773 H\n0.625154 0.260710 0.818227 H\n0.615562 0.282483 0.515193 H\n0.384437 0.782483 0.984807 H\n0.384437 0.717517 0.484807 H\n0.615562 0.217517 0.015193 H\n0.625154 0.239290 0.318228 H\n0.767502 0.308721 0.664468 O\n0.232498 0.808721 0.835532 O\n0.767502 0.191279 0.164468 O\n0.232498 0.691280 0.335532 O\n0.481991 0.772505 0.085691 O\n0.481991 0.727495 0.585691 O\n0.518008 0.227495 0.914309 O\n0.518008 0.272505 0.414309 O\n0.906348 0.841186 0.102809 F\n0.244663 0.431831 0.797070 F\n0.755337 0.931831 0.702930 F\n0.755337 0.568169 0.202930 F\n0.244663 0.068169 0.297070 F\n0.216433 0.385997 0.065163 F\n0.783567 0.885997 0.434837 F\n0.783567 0.614003 0.934837 F\n0.216433 0.114003 0.565163 F\n0.093651 0.158814 0.897191 F\n0.906348 0.658815 0.602809 F\n0.093651 0.341186 0.397191 F\n",
"nsites": 40,
"nelements": 4,
"elements": [
"B",
"H",
"O",
"F"
],
"chemical_system": "B-F-H-O",
"density": 2.0281075938135937,
"density_atomic": 0.1176225864656628,
"volume": 340.070739829183,
"volume_molar": 5.119884659021696,
"formula_full": "B4 H16 O8 F12",
"formula_reduced": "BH4O2F3",
"formula_anonymous": "AB2C3D4",
"energy_above_hull": 2.110804043083334,
"spacegroup": 14
},
{
"id": "jvasp-101102",
"created_at": "2022-09-04T14:36:34.804026Z",
"updated_at": "2022-09-04T14:36:34.804053Z",
"structure_string": "Te1 Pb3 Cl2 O4\n1.0\n6.869743 0.038488 0.000000\n-4.603843 5.098968 0.000000\n-0.000000 -0.000000 5.610859\nTe Pb Cl O\n1 3 2 4\ndirect\n0.071903 0.928098 0.500000 Te\n0.611506 0.388495 -0.000000 Pb\n0.389251 0.610749 0.500000 Pb\n0.895121 0.104880 -0.000000 Pb\n0.259757 0.740244 -0.000000 Cl\n0.748874 0.251127 0.500000 Cl\n0.772818 0.761024 0.266570 O\n0.772818 0.761024 0.733430 O\n0.238977 0.227183 0.266570 O\n0.238977 0.227183 0.733430 O\n",
"nsites": 10,
"nelements": 4,
"elements": [
"Te",
"Pb",
"Cl",
"O"
],
"chemical_system": "Cl-O-Pb-Te",
"density": 7.432052643178868,
"density_atomic": 0.05062400737698638,
"volume": 197.5347373338522,
"volume_molar": 11.895819932140851,
"formula_full": "Te1 Pb3 Cl2 O4",
"formula_reduced": "TePb3(ClO2)2",
"formula_anonymous": "AB2C3D4",
"energy_above_hull": 1.2436212361666663,
"spacegroup": 38
},
{
"id": "jvasp-105424",
"created_at": "2022-09-04T14:36:48.603573Z",
"updated_at": "2022-09-04T14:36:48.603598Z",
"structure_string": "Pr2 Mn3 Co1 Ge4\n1.0\n4.034593 0.000000 0.000000\n0.000000 4.034593 0.000000\n-0.000000 -0.000000 10.792439\nPr Mn Co Ge\n2 3 1 4\ndirect\n0.000000 0.000000 0.004076 Pr\n0.500000 0.500000 0.495924 Pr\n0.500000 0.000000 0.750000 Mn\n0.500000 0.000000 0.250000 Mn\n-0.000000 0.500000 0.750000 Mn\n-0.000000 0.500000 0.250000 Co\n0.500000 0.500000 0.130190 Ge\n0.000000 0.000000 0.624252 Ge\n0.000000 0.000000 0.369810 Ge\n0.500000 0.500000 0.875748 Ge\n",
"nsites": 10,
"nelements": 4,
"elements": [
"Pr",
"Mn",
"Co",
"Ge"
],
"chemical_system": "Co-Ge-Mn-Pr",
"density": 7.5250606133187885,
"density_atomic": 0.05692210288834303,
"volume": 175.6786817875606,
"volume_molar": 10.579617502559385,
"formula_full": "Pr2 Mn3 Co1 Ge4",
"formula_reduced": "Pr2Mn3CoGe4",
"formula_anonymous": "AB2C3D4",
"energy_above_hull": 2.657961612413793,
"spacegroup": 115
},
{
"id": "jvasp-103938",
"created_at": "2022-09-04T14:36:44.728857Z",
"updated_at": "2022-09-04T14:36:44.728871Z",
"structure_string": "Mg2 H4 C6 O8\n1.0\n4.144319 0.068919 1.199124\n0.255448 5.856466 0.356202\n0.198852 0.075296 7.628614\nMg H C O\n2 4 6 8\ndirect\n-0.008317 0.827526 0.441237 Mg\n-0.015584 0.797724 0.013001 Mg\n0.195552 0.298055 0.427522 H\n0.237109 0.269913 0.710067 H\n0.585713 0.393610 0.416651 H\n0.230082 0.314985 0.936906 H\n0.389907 0.309338 0.795158 C\n0.444080 0.317789 0.338621 C\n0.654293 0.119869 0.776802 C\n0.509046 0.546987 0.724818 C\n0.443242 0.496068 0.185311 C\n0.616088 0.086621 0.297284 C\n0.174507 0.620706 0.208665 O\n0.695013 0.529591 0.053570 O\n0.785038 0.564259 0.603348 O\n0.466185 0.907200 0.370931 O\n0.684878 0.021226 0.924829 O\n0.921800 0.063131 0.211402 O\n0.829199 0.071806 0.616062 O\n0.314453 0.717429 0.781979 O\n",
"nsites": 20,
"nelements": 4,
"elements": [
"Mg",
"H",
"C",
"O"
],
"chemical_system": "C-H-Mg-O",
"density": 2.286252473630291,
"density_atomic": 0.10896771675965218,
"volume": 183.5405989474257,
"volume_molar": 5.526536610180526,
"formula_full": "Mg2 H4 C6 O8",
"formula_reduced": "MgH2C3O4",
"formula_anonymous": "AB2C3D4",
"energy_above_hull": 3.713805305,
"spacegroup": 1
},
{
"id": "jvasp-101931",
"created_at": "2022-09-04T14:37:00.967049Z",
"updated_at": "2022-09-04T14:37:00.967081Z",
"structure_string": "Mg2 H4 C6 O8\n1.0\n4.604879 0.024797 1.885982\n2.664707 6.368579 -0.134467\n-0.195111 -0.162247 6.041826\nMg H C O\n2 4 6 8\ndirect\n0.523892 0.191799 0.526973 Mg\n0.900513 0.103082 0.967648 Mg\n0.307871 0.929708 0.339596 H\n0.064651 0.644893 0.684660 H\n0.469644 0.638365 0.327636 H\n0.805565 0.658849 -0.028353 H\n0.827625 0.651973 0.782604 C\n0.294337 0.777393 0.311748 C\n0.588170 0.857077 0.779716 C\n0.809784 0.447043 0.709269 C\n0.185043 0.380557 0.197800 C\n0.056235 0.774628 0.260828 C\n0.445844 0.328681 0.223986 O\n0.002026 0.588306 0.221888 O\n0.583282 0.435369 0.671259 O\n0.070415 0.254793 0.158707 O\n0.328924 0.872056 0.783040 O\n0.825596 0.940631 0.248105 O\n0.665686 0.018818 0.773359 O\n0.046035 0.277791 0.695817 O\n",
"nsites": 20,
"nelements": 4,
"elements": [
"Mg",
"H",
"C",
"O"
],
"chemical_system": "C-H-Mg-O",
"density": 2.3545740822743895,
"density_atomic": 0.11222407177081697,
"volume": 178.21488460019367,
"volume_molar": 5.366175602947614,
"formula_full": "Mg2 H4 C6 O8",
"formula_reduced": "MgH2C3O4",
"formula_anonymous": "AB2C3D4",
"energy_above_hull": 3.720267305,
"spacegroup": 1
},
{
"id": "jvasp-22973",
"created_at": "2022-09-04T14:37:32.801063Z",
"updated_at": "2022-09-04T14:37:32.801095Z",
"structure_string": "K8 Li12 Ga4 O16\n1.0\n0.000000 5.540330 0.009321\n8.778813 0.000000 0.000000\n0.000000 -3.978904 -10.209076\nK Li Ga O\n8 12 4 16\ndirect\n0.296982 0.992635 0.138964 K\n0.703019 0.492635 0.361036 K\n0.703020 0.007365 0.861036 K\n0.296982 0.507365 0.638964 K\n0.280301 0.724835 0.392048 K\n0.719699 0.224835 0.107953 K\n0.719700 0.275165 0.607953 K\n0.280302 0.775164 0.892048 K\n0.374048 0.508881 0.070780 Li\n0.374048 0.991118 0.570780 Li\n0.625954 0.491118 0.929220 Li\n0.092939 0.463555 0.203529 Li\n0.907062 0.963555 0.296471 Li\n0.625953 0.008881 0.429220 Li\n0.092939 0.036445 0.703530 Li\n0.381774 0.238463 0.299067 Li\n0.618227 0.738463 0.200933 Li\n0.618227 0.761537 0.700933 Li\n0.381774 0.261537 0.799067 Li\n0.907063 0.536445 0.796471 Li\n0.101255 0.211798 0.436948 Ga\n0.898745 0.711797 0.063053 Ga\n0.101256 0.288202 0.936948 Ga\n0.898746 0.788202 0.563053 Ga\n0.220016 0.106606 0.885555 O\n0.257378 0.049198 0.376478 O\n0.220016 0.393393 0.385555 O\n0.742623 0.549197 0.123523 O\n0.779985 0.893393 0.114445 O\n0.779985 0.606606 0.614445 O\n0.233659 0.310674 0.120578 O\n0.256065 0.677438 0.143087 O\n0.766343 0.689325 0.879423 O\n0.233659 0.189325 0.620578 O\n0.743935 0.177438 0.356913 O\n0.256066 0.822562 0.643087 O\n0.743936 0.322562 0.856914 O\n0.742624 0.950802 0.623523 O\n0.766342 0.810674 0.379422 O\n0.257378 0.450802 0.876478 O\n",
"nsites": 40,
"nelements": 4,
"elements": [
"K",
"Li",
"Ga",
"O"
],
"chemical_system": "Ga-K-Li-O",
"density": 3.115354573686441,
"density_atomic": 0.08060964013321711,
"volume": 496.2185655945765,
"volume_molar": 7.470745124339581,
"formula_full": "K8 Li12 Ga4 O16",
"formula_reduced": "K2Li3GaO4",
"formula_anonymous": "AB2C3D4",
"energy_above_hull": 0.9309672325,
"spacegroup": 14
},
{
"id": "jvasp-109165",
"created_at": "2022-09-04T14:37:59.305113Z",
"updated_at": "2022-09-04T14:37:59.305130Z",
"structure_string": "Li1 Bi3 Cl2 O4\n1.0\n6.634985 0.045503 0.000000\n-4.394194 4.971534 0.000000\n-0.000000 -0.000000 5.487204\nLi Bi Cl O\n1 3 2 4\ndirect\n0.696080 0.303919 0.500000 Li\n0.149609 0.850390 -0.000000 Bi\n0.841144 0.158855 -0.000000 Bi\n0.345352 0.654646 0.500000 Bi\n0.495357 0.504642 -0.000000 Cl\n0.987017 0.012981 0.500000 Cl\n0.494235 0.001518 0.750739 O\n-0.001518 0.505764 0.249260 O\n-0.001518 0.505764 0.750739 O\n0.494235 0.001518 0.249260 O\n",
"nsites": 10,
"nelements": 4,
"elements": [
"Li",
"Bi",
"Cl",
"O"
],
"chemical_system": "Bi-Cl-Li-O",
"density": 7.010490451598221,
"density_atomic": 0.054915374751654034,
"volume": 182.098365807816,
"volume_molar": 10.966219910606393,
"formula_full": "Li1 Bi3 Cl2 O4",
"formula_reduced": "LiBi3(ClO2)2",
"formula_anonymous": "AB2C3D4",
"energy_above_hull": 1.4313365035,
"spacegroup": 38
},
{
"id": "jvasp-107529",
"created_at": "2022-09-04T14:37:15.978211Z",
"updated_at": "2022-09-04T14:37:15.978230Z",
"structure_string": "Rb2 Zn3 Ge1 As4\n1.0\n7.873257 0.047846 0.000000\n-5.715290 5.415341 0.000000\n-0.000000 -0.000000 5.867223\nRb Zn Ge As\n2 3 1 4\ndirect\n0.500000 0.000000 0.250808 Rb\n-0.000000 0.500000 0.749191 Rb\n0.500000 0.500000 0.500000 Zn\n0.500000 0.500000 -0.000000 Zn\n0.000000 0.000000 0.500000 Zn\n0.000000 0.000000 0.000000 Ge\n0.649891 0.862269 0.756079 As\n0.137732 0.350109 0.243920 As\n0.862269 0.649891 0.243920 As\n0.350109 0.137732 0.756079 As\n",
"nsites": 10,
"nelements": 4,
"elements": [
"Rb",
"Zn",
"Ge",
"As"
],
"chemical_system": "As-Ge-Rb-Zn",
"density": 4.877434829117474,
"density_atomic": 0.03972012984482868,
"volume": 251.76151334515185,
"volume_molar": 15.16143271315123,
"formula_full": "Rb2 Zn3 Ge1 As4",
"formula_reduced": "Rb2Zn3GeAs4",
"formula_anonymous": "AB2C3D4",
"energy_above_hull": 0.3803184150000001,
"spacegroup": 21
},
{
"id": "jvasp-112258",
"created_at": "2022-09-04T14:38:44.262398Z",
"updated_at": "2022-09-04T14:38:44.262427Z",
"structure_string": "Cd1 H2 C3 O4\n1.0\n3.970363 -0.086849 -0.260236\n-0.228347 3.966960 -0.291569\n-0.036503 0.009012 6.323259\nCd H C O\n1 2 3 4\ndirect\n0.565769 0.732436 0.509270 Cd\n0.411071 0.276166 0.008917 H\n0.107502 0.578700 0.008835 H\n0.966481 0.134195 0.803437 C\n0.018075 0.186221 0.211069 C\n0.140009 0.308051 0.005819 C\n0.782981 0.950712 0.207562 O\n0.163307 0.332308 0.384014 O\n0.697828 0.244077 0.720503 O\n0.076669 0.865592 0.720893 O\n",
"nsites": 10,
"nelements": 4,
"elements": [
"Cd",
"H",
"C",
"O"
],
"chemical_system": "C-Cd-H-O",
"density": 3.5811898403612306,
"density_atomic": 0.1005631504260217,
"volume": 99.44000319835249,
"volume_molar": 5.988416964353289,
"formula_full": "Cd1 H2 C3 O4",
"formula_reduced": "CdH2C3O4",
"formula_anonymous": "AB2C3D4",
"energy_above_hull": 3.627016375,
"spacegroup": 8
}
]
}