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=-nelements&page=284",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-nelements&page=282",
"results": [
{
"id": "jvasp-43290",
"created_at": "2022-09-04T14:36:10.065379Z",
"updated_at": "2022-09-04T14:36:10.065398Z",
"structure_string": "Li2 Ni3 Sn1 O8\n1.0\n5.967953 0.087227 0.061680\n3.059518 5.124785 0.061680\n3.059518 1.766414 4.811134\nLi Ni Sn O\n2 3 1 8\ndirect\n0.118311 0.118311 0.118311 Li\n0.881690 0.881688 0.881689 Li\n0.000001 0.499999 0.500000 Ni\n0.500000 0.000000 0.500000 Ni\n0.500000 0.500000 0.000000 Ni\n0.500001 0.500000 0.500000 Sn\n0.265141 0.265140 0.265140 O\n0.252109 0.252108 0.714329 O\n0.252109 0.714328 0.252108 O\n0.714329 0.252108 0.252108 O\n0.285672 0.747891 0.747891 O\n0.747892 0.285671 0.747891 O\n0.747892 0.747891 0.285671 O\n0.734860 0.734859 0.734859 O\n",
"nsites": 14,
"nelements": 4,
"elements": [
"Li",
"Ni",
"Sn",
"O"
],
"chemical_system": "Li-Ni-O-Sn",
"density": 5.014735227001023,
"density_atomic": 0.0968224740161363,
"volume": 144.5945287213667,
"volume_molar": 6.219775750613807,
"formula_full": "Li2 Ni3 Sn1 O8",
"formula_reduced": "Li2Ni3SnO8",
"formula_anonymous": "AB2C3D8",
"energy_above_hull": 2.036356921428572,
"spacegroup": 166
},
{
"id": "jvasp-42812",
"created_at": "2022-09-04T14:36:10.222611Z",
"updated_at": "2022-09-04T14:36:10.222636Z",
"structure_string": "Li6 V2 O6 F4\n1.0\n5.297428 -0.091535 0.080437\n-2.206725 4.816792 -0.080437\n-1.024225 0.669926 7.863803\nLi V O F\n6 2 6 4\ndirect\n0.246530 0.428312 0.565387 Li\n0.427200 0.205370 0.928971 Li\n0.571689 0.753471 0.065388 Li\n0.794632 0.572800 0.428972 Li\n0.622028 0.029085 0.369662 Li\n0.970917 0.377973 0.869662 Li\n0.171083 0.175110 0.245767 V\n0.824891 0.828918 0.745766 V\n0.861439 0.876936 0.253790 O\n0.741955 0.579929 0.912836 O\n0.420073 0.258046 0.412836 O\n0.123064 0.138563 0.753790 O\n0.224115 0.404899 0.071173 O\n0.595102 0.775886 0.571172 O\n0.641777 0.018281 0.867103 F\n0.006230 0.621050 0.652031 F\n0.378952 0.993770 0.152031 F\n0.981721 0.358224 0.367103 F\n",
"nsites": 18,
"nelements": 4,
"elements": [
"Li",
"V",
"O",
"F"
],
"chemical_system": "F-Li-O-V",
"density": 2.6245793686541283,
"density_atomic": 0.09016906862837552,
"volume": 199.62499639633114,
"volume_molar": 6.678721263962215,
"formula_full": "Li6 V2 O6 F4",
"formula_reduced": "Li3VO3F2",
"formula_anonymous": "AB2C3D3",
"energy_above_hull": 1.4577305850000002,
"spacegroup": 9
},
{
"id": "jvasp-60632",
"created_at": "2022-09-04T14:36:10.157532Z",
"updated_at": "2022-09-04T14:36:10.157552Z",
"structure_string": "Mg6 Si4 H8 O18\n1.0\n2.677200 -4.637047 -0.000000\n2.677200 4.637047 -0.000000\n-0.000000 0.000000 14.560101\nMg Si H O\n6 4 8 18\ndirect\n0.331255 -0.000000 0.223115 Mg\n0.331255 0.331255 0.723115 Mg\n-0.000000 0.668745 0.723115 Mg\n-0.000000 0.331255 0.223115 Mg\n0.668745 -0.000000 0.723115 Mg\n0.668745 0.668745 0.223115 Mg\n0.333333 0.666667 0.030718 Si\n0.666667 0.333333 0.530718 Si\n0.333333 0.666667 0.530718 Si\n0.666667 0.333333 0.030718 Si\n0.651744 0.651744 0.856805 H\n-0.000000 0.348256 0.856805 H\n-0.000000 0.651744 0.356805 H\n0.651744 -0.000000 0.356805 H\n0.348256 -0.000000 0.856805 H\n0.000000 0.000000 0.078337 H\n0.000000 0.000000 0.578337 H\n0.348256 0.348256 0.356805 H\n-0.000000 0.665181 0.290055 O\n-0.000000 0.334819 0.790055 O\n0.665181 0.665181 0.790055 O\n0.665181 -0.000000 0.290055 O\n0.515912 -0.000000 0.488676 O\n0.515912 0.515912 0.988676 O\n-0.000000 0.484088 0.988676 O\n-0.000000 0.515912 0.488676 O\n0.484088 -0.000000 0.988676 O\n0.666667 0.333333 0.141254 O\n0.333333 0.666667 0.641254 O\n0.666667 0.333333 0.641254 O\n0.333333 0.666667 0.141254 O\n0.000000 0.000000 0.145061 O\n0.000000 0.000000 0.645061 O\n0.334819 0.334819 0.290055 O\n0.484088 0.484088 0.488676 O\n0.334819 -0.000000 0.790055 O\n",
"nsites": 36,
"nelements": 4,
"elements": [
"Mg",
"Si",
"H",
"O"
],
"chemical_system": "H-Mg-O-Si",
"density": 2.545764890604976,
"density_atomic": 0.09958313708236255,
"volume": 361.50698858005813,
"volume_molar": 6.047349919313396,
"formula_full": "Mg6 Si4 H8 O18",
"formula_reduced": "Mg3Si2H4O9",
"formula_anonymous": "A2B3C4D9",
"energy_above_hull": 2.360200325,
"spacegroup": 185
},
{
"id": "jvasp-95265",
"created_at": "2022-09-04T14:36:10.211135Z",
"updated_at": "2022-09-04T14:36:10.211159Z",
"structure_string": "Fe2 P6 H12 O18\n1.0\n6.505436 3.219690 -1.817316\n-6.505436 3.219690 1.817316\n0.123674 0.000000 9.659753\nFe P H O\n2 6 12 18\ndirect\n0.089308 0.699125 0.643488 Fe\n0.300875 0.910692 0.143488 Fe\n0.794177 0.390033 0.066334 P\n0.609967 0.205823 0.566334 P\n0.942015 0.857718 0.321017 P\n0.142282 0.057985 0.821016 P\n0.321232 0.601717 0.442679 P\n0.398282 0.678768 0.942678 P\n0.664830 0.693554 0.544598 H\n0.702562 0.944281 0.278986 H\n0.055719 0.297438 0.778986 H\n0.399573 0.196001 0.362428 H\n0.803998 0.600427 0.862428 H\n0.306446 0.335170 0.044598 H\n0.215320 0.390947 0.391078 H\n0.353354 0.213177 0.762481 H\n0.786823 0.646645 0.262482 H\n0.723569 0.143664 0.515830 H\n0.856337 0.276430 0.015830 H\n0.609053 0.784680 0.891077 H\n0.513223 0.637086 0.570072 O\n0.362914 0.486777 0.070073 O\n0.437643 0.799736 0.321336 O\n0.200264 0.562357 0.821336 O\n0.859050 0.010836 0.253372 O\n0.989164 0.140950 0.753371 O\n0.182932 0.985609 0.276370 O\n0.014391 0.817068 0.776369 O\n0.524068 0.310850 0.432106 O\n0.937071 0.815044 0.483924 O\n0.689150 0.475932 0.932106 O\n0.604454 0.220922 0.164464 O\n0.779078 0.395546 0.664464 O\n0.405584 0.988438 0.640731 O\n0.011562 0.594416 0.140731 O\n0.136379 0.579214 0.502808 O\n0.184955 0.062929 0.983924 O\n0.420786 0.863620 0.002808 O\n",
"nsites": 38,
"nelements": 4,
"elements": [
"Fe",
"P",
"H",
"O"
],
"chemical_system": "Fe-H-O-P",
"density": 2.4436279346750505,
"density_atomic": 0.09357214809277827,
"volume": 406.1037474775336,
"volume_molar": 6.435826132824216,
"formula_full": "Fe2 P6 H12 O18",
"formula_reduced": "FeP3(H2O3)3",
"formula_anonymous": "AB3C6D9",
"energy_above_hull": 3.209695447368421,
"spacegroup": 9
},
{
"id": "jvasp-85964",
"created_at": "2022-09-04T14:36:10.215652Z",
"updated_at": "2022-09-04T14:36:10.215678Z",
"structure_string": "Sr2 Ni1 Te1 O6\n1.0\n4.958338 -0.031472 2.341052\n1.152916 4.764488 3.786085\n-0.014354 -0.027657 6.193733\nSr Ni Te O\n2 1 1 6\ndirect\n0.182410 0.304328 0.304330 Sr\n0.817592 0.695667 0.695675 Sr\n0.499999 0.000006 -0.000008 Ni\n-0.000002 -0.000002 0.000002 Te\n0.267457 0.746642 0.232685 O\n0.732550 0.253358 0.767311 O\n0.166857 0.799101 0.799103 O\n0.732549 0.767316 0.253356 O\n0.267452 0.232690 0.746641 O\n0.833145 0.200895 0.200901 O\n",
"nsites": 10,
"nelements": 4,
"elements": [
"Sr",
"Ni",
"Te",
"O"
],
"chemical_system": "Ni-O-Sr-Te",
"density": 5.1630202083381285,
"density_atomic": 0.06795717885934777,
"volume": 147.15148815546308,
"volume_molar": 8.861669747156716,
"formula_full": "Sr2 Ni1 Te1 O6",
"formula_reduced": "Sr2NiTeO6",
"formula_anonymous": "ABC2D6",
"energy_above_hull": 1.6421243786666668,
"spacegroup": 12
},
{
"id": "jvasp-42633",
"created_at": "2022-09-04T14:36:10.233213Z",
"updated_at": "2022-09-04T14:36:10.233249Z",
"structure_string": "Li2 Mn4 P4 O16\n1.0\n0.000000 5.262601 0.187635\n5.955804 0.000000 0.000000\n0.000000 -5.010359 -9.465336\nLi Mn P O\n2 4 4 16\ndirect\n0.069119 0.370417 0.445374 Li\n0.069119 0.629583 0.945375 Li\n0.440238 0.879751 0.667230 Mn\n0.532443 0.356896 0.856060 Mn\n0.440237 0.120249 0.167230 Mn\n0.532443 0.643104 0.356060 Mn\n0.899510 0.603699 0.632283 P\n0.100015 0.110553 0.863550 P\n0.100014 0.889446 0.363550 P\n0.899510 0.396301 0.132283 P\n0.764189 0.879518 0.268825 O\n0.798144 0.818031 0.535664 O\n0.772782 0.420415 0.510230 O\n0.213554 0.919801 0.974391 O\n0.223539 0.331815 0.951148 O\n0.774614 0.388326 0.234818 O\n0.242393 0.589838 0.720011 O\n0.223539 0.668185 0.451148 O\n0.798144 0.181968 0.035664 O\n0.772782 0.579585 0.010230 O\n0.213554 0.080198 0.474391 O\n0.764189 0.120482 0.768825 O\n0.242393 0.410161 0.220010 O\n0.253023 0.894887 0.267794 O\n0.253024 0.105112 0.767794 O\n0.774614 0.611674 0.734818 O\n",
"nsites": 26,
"nelements": 4,
"elements": [
"Li",
"Mn",
"P",
"O"
],
"chemical_system": "Li-Mn-O-P",
"density": 3.500060544422364,
"density_atomic": 0.08932465468444017,
"volume": 291.07305359142964,
"volume_molar": 6.741857308348512,
"formula_full": "Li2 Mn4 P4 O16",
"formula_reduced": "LiMn2(PO4)2",
"formula_anonymous": "AB2C2D8",
"energy_above_hull": 3.0919564217506634,
"spacegroup": 7
},
{
"id": "jvasp-98011",
"created_at": "2022-09-04T14:36:11.572612Z",
"updated_at": "2022-09-04T14:36:11.572640Z",
"structure_string": "K2 Ce2 Ge2 Se8\n1.0\n6.570765 0.000000 -2.134624\n0.000000 7.066268 0.000000\n-0.033853 0.000000 8.929054\nK Ce Ge Se\n2 2 2 8\ndirect\n0.248512 0.718208 0.938551 K\n0.751489 0.218208 0.061450 K\n0.732195 0.213034 0.555228 Ce\n0.267806 0.713035 0.444772 Ce\n0.716829 0.746383 0.315710 Ge\n0.283172 0.246383 0.684290 Ge\n0.917849 0.750958 0.144522 Se\n0.082152 0.250957 0.855478 Se\n0.492755 0.968883 0.719784 Se\n0.927575 0.805867 0.581424 Se\n0.072426 0.305867 0.418576 Se\n0.463459 0.991959 0.265963 Se\n0.536542 0.491959 0.734037 Se\n0.507246 0.468883 0.280216 Se\n",
"nsites": 14,
"nelements": 4,
"elements": [
"K",
"Ce",
"Ge",
"Se"
],
"chemical_system": "Ce-Ge-K-Se",
"density": 4.55320682401795,
"density_atomic": 0.03381051507681705,
"volume": 414.07236678270596,
"volume_molar": 17.811443411370025,
"formula_full": "K2 Ce2 Ge2 Se8",
"formula_reduced": "KCeGeSe4",
"formula_anonymous": "ABCD4",
"energy_above_hull": 1.0748047023809524,
"spacegroup": 4
},
{
"id": "jvasp-95425",
"created_at": "2022-09-04T14:36:11.599468Z",
"updated_at": "2022-09-04T14:36:11.599485Z",
"structure_string": "Cu4 Hg4 S4 I4\n1.0\n7.059173 0.000000 0.000000\n0.000000 7.180392 0.000000\n0.000000 0.000000 8.472455\nCu Hg S I\n4 4 4 4\ndirect\n0.294858 0.077080 0.359222 Cu\n0.794858 0.922920 0.640777 Cu\n0.794858 0.422920 0.859222 Cu\n0.294858 0.577080 0.140778 Cu\n0.185285 0.030261 0.951850 Hg\n0.685284 0.969738 0.048149 Hg\n0.685284 0.469739 0.451851 Hg\n0.185285 0.530261 0.548149 Hg\n0.877316 0.116756 0.841432 S\n0.377316 0.883243 0.158568 S\n0.377316 0.383243 0.341432 S\n0.877316 0.616756 0.658567 S\n0.409011 0.914300 0.625183 I\n0.909010 0.085700 0.374816 I\n0.909010 0.585700 0.125183 I\n0.409011 0.414300 0.874816 I\n",
"nsites": 16,
"nelements": 4,
"elements": [
"Cu",
"Hg",
"S",
"I"
],
"chemical_system": "Cu-Hg-I-S",
"density": 6.544048031356332,
"density_atomic": 0.03725707294556858,
"volume": 429.448658604381,
"volume_molar": 16.1637516956798,
"formula_full": "Cu4 Hg4 S4 I4",
"formula_reduced": "CuHgSI",
"formula_anonymous": "ABCD",
"energy_above_hull": 0.0039875,
"spacegroup": 33
},
{
"id": "jvasp-96605",
"created_at": "2022-09-04T14:36:10.267767Z",
"updated_at": "2022-09-04T14:36:10.267797Z",
"structure_string": "Na8 H8 N8 O16\n1.0\n6.361084 -0.000073 -0.000157\n-0.000112 9.688129 -0.000165\n-0.000168 -0.000114 6.667072\nNa H N O\n8 8 8 16\ndirect\n0.000000 0.500000 0.500001 Na\n0.000001 0.500000 0.000001 Na\n-0.000000 0.000000 0.500000 Na\n0.999998 0.000001 -0.000001 Na\n0.327801 0.250002 0.500004 Na\n0.672201 0.750001 0.999996 Na\n0.672198 0.749998 0.499996 Na\n0.327798 0.250001 0.000004 Na\n0.820338 0.277396 0.106784 H\n0.179668 0.722613 0.606786 H\n0.820332 0.222608 0.893212 H\n0.179661 0.777392 0.393217 H\n0.179669 0.777395 0.106789 H\n0.820331 0.277388 0.393211 H\n0.820338 0.222609 0.606780 H\n0.179659 0.722607 0.893217 H\n0.612511 0.025568 0.249991 N\n0.612510 0.474436 0.749991 N\n0.387489 0.525566 0.250010 N\n0.387487 0.974434 0.750007 N\n0.425331 0.526128 0.750005 N\n0.574665 0.473872 0.249996 N\n0.425335 0.973871 0.250005 N\n0.574667 0.026129 0.749994 N\n0.078542 0.749999 -0.000001 O\n0.921456 0.250001 0.500000 O\n0.764014 0.571176 0.749989 O\n0.235986 0.428825 0.250012 O\n0.764013 0.928828 0.249989 O\n0.235985 0.071173 0.750009 O\n0.391994 0.661308 0.750013 O\n0.608006 0.338693 0.249987 O\n0.391989 0.838692 0.250013 O\n0.608009 0.161309 0.749986 O\n0.262169 0.441346 0.750010 O\n0.737831 0.558655 0.249991 O\n0.262172 0.058651 0.250009 O\n0.737827 0.941349 0.749990 O\n0.078542 0.749998 0.500004 O\n0.921457 0.250003 0.999997 O\n",
"nsites": 40,
"nelements": 4,
"elements": [
"Na",
"H",
"N",
"O"
],
"chemical_system": "H-N-Na-O",
"density": 2.2633454614934068,
"density_atomic": 0.09735400064168855,
"volume": 410.8716615275013,
"volume_molar": 6.185817450034223,
"formula_full": "Na8 H8 N8 O16",
"formula_reduced": "NaHNO2",
"formula_anonymous": "ABCD2",
"energy_above_hull": 2.34107385,
"spacegroup": 57
},
{
"id": "jvasp-88284",
"created_at": "2022-09-04T14:36:10.280431Z",
"updated_at": "2022-09-04T14:36:10.280455Z",
"structure_string": "Ca4 Mg4 Si4 O16\n1.0\n4.857627 -0.000000 0.000000\n0.000000 6.397389 0.000000\n0.000000 0.000000 11.133673\nCa Mg Si O\n4 4 4 16\ndirect\n0.522073 0.250000 0.776358 Ca\n0.977928 0.250000 0.276358 Ca\n0.022073 0.750000 0.723642 Ca\n0.477927 0.750000 0.223642 Ca\n0.500000 0.500000 0.500000 Mg\n0.500000 0.000000 0.500000 Mg\n0.000000 0.500000 0.000000 Mg\n0.000000 0.000000 0.000000 Mg\n0.587595 0.750000 0.918989 Si\n0.912405 0.750000 0.418989 Si\n0.412405 0.250000 0.081010 Si\n0.087595 0.250000 0.581010 Si\n0.248747 0.750000 0.422996 O\n0.748747 0.250000 0.077004 O\n0.227957 0.456132 0.647355 O\n0.752122 0.750000 0.552195 O\n0.252122 0.250000 0.947804 O\n0.247879 0.250000 0.447804 O\n0.747879 0.750000 0.052195 O\n0.727957 0.956132 0.852645 O\n0.227957 0.043868 0.647355 O\n0.272044 0.456132 0.147355 O\n0.772044 0.543868 0.352645 O\n0.272044 0.043868 0.147355 O\n0.772044 0.956132 0.352645 O\n0.727957 0.543868 0.852645 O\n0.251254 0.750000 0.922996 O\n0.751254 0.250000 0.577003 O\n",
"nsites": 28,
"nelements": 4,
"elements": [
"Ca",
"Mg",
"Si",
"O"
],
"chemical_system": "Ca-Mg-O-Si",
"density": 3.003751229879091,
"density_atomic": 0.0809268519150431,
"volume": 345.99146435838577,
"volume_molar": 7.441461786159722,
"formula_full": "Ca4 Mg4 Si4 O16",
"formula_reduced": "CaMgSiO4",
"formula_anonymous": "ABCD4",
"energy_above_hull": 1.4170902957142857,
"spacegroup": 62
},
{
"id": "jvasp-105691",
"created_at": "2022-09-04T14:36:10.335841Z",
"updated_at": "2022-09-04T14:36:10.335865Z",
"structure_string": "K2 Rb1 Pr1 F6\n1.0\n6.017918 -0.000000 3.474446\n2.005973 5.673747 3.474446\n0.000000 0.000000 6.948893\nK Rb Pr F\n2 1 1 6\ndirect\n0.750000 0.750000 0.750000 K\n0.250000 0.250000 0.250000 K\n0.500000 0.500000 0.500000 Rb\n0.000000 0.000000 0.000000 Pr\n0.766962 0.233038 0.233039 F\n0.233038 0.233038 0.766962 F\n0.233038 0.766962 0.766962 F\n0.233038 0.766962 0.233039 F\n0.766962 0.233038 0.766962 F\n0.766962 0.766962 0.233039 F\n",
"nsites": 10,
"nelements": 4,
"elements": [
"K",
"Rb",
"Pr",
"F"
],
"chemical_system": "F-K-Pr-Rb",
"density": 2.9293922314550422,
"density_atomic": 0.0421471432899536,
"volume": 237.26400461365668,
"volume_molar": 14.2883723306473,
"formula_full": "K2 Rb1 Pr1 F6",
"formula_reduced": "K2RbPrF6",
"formula_anonymous": "ABC2D6",
"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-99699",
"created_at": "2022-09-04T14:36:11.240496Z",
"updated_at": "2022-09-04T14:36:11.240530Z",
"structure_string": "K2 Y1 Ag1 I6\n1.0\n7.307603 -0.000000 4.219047\n2.435868 6.889675 4.219047\n-0.000000 0.000000 8.438094\nK Y Ag I\n2 1 1 6\ndirect\n0.750000 0.749999 0.750000 K\n0.250000 0.250000 0.250000 K\n0.500000 0.500000 0.500000 Y\n0.000000 0.000000 0.000000 Ag\n0.750658 0.249342 0.249343 I\n0.249342 0.249342 0.750658 I\n0.249342 0.750657 0.750658 I\n0.249342 0.750657 0.249343 I\n0.750658 0.249342 0.750658 I\n0.750658 0.750657 0.249343 I\n",
"nsites": 10,
"nelements": 4,
"elements": [
"K",
"Y",
"Ag",
"I"
],
"chemical_system": "Ag-I-K-Y",
"density": 4.050954835878631,
"density_atomic": 0.023538672129809767,
"volume": 424.8328004592847,
"volume_molar": 25.584029238308055,
"formula_full": "K2 Y1 Ag1 I6",
"formula_reduced": "K2YAgI6",
"formula_anonymous": "ABC2D6",
"energy_above_hull": 0.0,
"spacegroup": 225
}
]
}