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=-updated_at&page=1262",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-updated_at&page=1260",
"results": [
{
"id": "jvasp-21799",
"created_at": "2022-09-04T14:38:06.723493Z",
"updated_at": "2022-09-04T14:38:06.723521Z",
"structure_string": "Pr4 B16\n1.0\n7.274420 0.000000 -0.000000\n0.000000 7.274420 -0.000000\n-0.000000 -0.000000 4.151158\nPr B\n4 16\ndirect\n0.182554 0.682554 0.000000 Pr\n0.682554 0.817446 0.000000 Pr\n0.317446 0.182554 0.000000 Pr\n0.817446 0.317446 0.000000 Pr\n0.173636 0.961134 0.500000 B\n0.038866 0.173636 0.500000 B\n0.411535 0.911535 0.500000 B\n0.911535 0.588465 0.500000 B\n0.088465 0.411535 0.500000 B\n0.588465 0.088465 0.500000 B\n0.500000 0.500000 0.205464 B\n0.500000 0.500000 0.794536 B\n0.826364 0.038866 0.500000 B\n0.000000 0.000000 0.205464 B\n0.461134 0.673636 0.500000 B\n0.538866 0.326364 0.500000 B\n0.673636 0.538866 0.500000 B\n0.326364 0.461134 0.500000 B\n0.000000 0.000000 0.794536 B\n0.961134 0.826364 0.500000 B\n",
"nsites": 20,
"nelements": 2,
"elements": [
"Pr",
"B"
],
"chemical_system": "B-Pr",
"density": 5.568249610920733,
"density_atomic": 0.09104665354713927,
"volume": 219.66760139783753,
"volume_molar": 6.614346080146753,
"formula_full": "Pr4 B16",
"formula_reduced": "PrB4",
"formula_anonymous": "AB4",
"energy_above_hull": 4.061074036666668,
"spacegroup": 127
},
{
"id": "jvasp-29489",
"created_at": "2022-09-04T14:38:06.714849Z",
"updated_at": "2022-09-04T14:38:06.714877Z",
"structure_string": "Al8 H24 O24\n1.0\n5.075468 0.000000 -0.027961\n0.000000 8.726173 0.000000\n-0.009479 0.000000 9.323782\nAl H O\n8 24 24\ndirect\n0.463619 0.832864 0.503582 Al\n0.029212 0.334991 0.496389 Al\n0.963619 0.667136 0.003583 Al\n0.529212 0.165009 0.996389 Al\n0.036381 0.332864 0.996417 Al\n0.970788 0.665009 0.503611 Al\n0.470788 0.834990 0.003611 Al\n0.536381 0.167136 0.496418 Al\n0.825726 0.204360 0.710052 H\n0.355928 0.598092 0.153338 H\n0.046042 0.505530 0.289396 H\n0.546042 0.994469 0.789396 H\n0.455752 0.419053 0.615151 H\n0.544248 0.580947 0.384849 H\n0.325726 0.295640 0.210052 H\n0.644072 0.401908 0.846662 H\n0.674274 0.704360 0.789948 H\n0.453958 0.005531 0.210604 H\n0.812669 0.958464 0.371010 H\n0.735735 0.765943 0.215647 H\n0.955753 0.080947 0.115151 H\n0.855928 0.901908 0.653338 H\n0.235734 0.734056 0.715647 H\n0.687331 0.458465 0.128990 H\n0.144072 0.098092 0.346662 H\n0.264265 0.234056 0.784353 H\n0.044247 0.919052 0.884848 H\n0.312669 0.541535 0.871010 H\n0.174274 0.795640 0.289948 H\n0.764266 0.265944 0.284353 H\n0.187331 0.041535 0.628990 H\n0.953958 0.494469 0.710604 H\n0.142026 0.827290 0.390556 O\n0.354098 0.323773 0.603988 O\n0.371881 0.012381 0.611861 O\n0.857974 0.172709 0.609444 O\n0.642026 0.672709 0.890556 O\n0.275150 0.696033 0.618223 O\n0.775371 0.807575 0.618094 O\n0.724850 0.303967 0.381777 O\n0.724629 0.307575 0.881906 O\n0.645903 0.676226 0.396012 O\n0.128119 0.512381 0.888139 O\n0.127459 0.510351 0.386220 O\n0.871881 0.487618 0.111861 O\n0.224850 0.196033 0.881777 O\n0.224629 0.192425 0.381906 O\n0.775150 0.803966 0.118223 O\n0.275371 0.692425 0.118094 O\n0.627459 0.989648 0.886220 O\n0.372541 0.010352 0.113779 O\n0.628119 0.987618 0.388139 O\n0.145902 0.823773 0.896012 O\n0.872541 0.489648 0.613779 O\n0.854098 0.176226 0.103988 O\n0.357974 0.327291 0.109444 O\n",
"nsites": 56,
"nelements": 3,
"elements": [
"Al",
"H",
"O"
],
"chemical_system": "Al-H-O",
"density": 2.509365422944332,
"density_atomic": 0.1356120983476387,
"volume": 412.9425079497347,
"volume_molar": 4.44071055117986,
"formula_full": "Al8 H24 O24",
"formula_reduced": "Al(HO)3",
"formula_anonymous": "AB3C3",
"energy_above_hull": 2.4483790428571437,
"spacegroup": 14
},
{
"id": "jvasp-108819",
"created_at": "2022-09-04T14:38:06.704940Z",
"updated_at": "2022-09-04T14:38:06.704972Z",
"structure_string": "Ca1 Rh1 N2\n1.0\n3.097820 0.001631 4.403858\n1.394955 2.765970 4.403858\n0.002647 0.001631 5.384278\nCa Rh N\n1 1 2\ndirect\n0.000000 0.000000 0.000000 Ca\n0.500001 0.500000 0.500000 Rh\n0.766523 0.766520 0.766520 N\n0.233480 0.233479 0.233479 N\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ca",
"Rh",
"N"
],
"chemical_system": "Ca-N-Rh",
"density": 6.16226457067257,
"density_atomic": 0.08680864894691219,
"volume": 46.07835795769842,
"volume_molar": 6.937258940273151,
"formula_full": "Ca1 Rh1 N2",
"formula_reduced": "CaRhN2",
"formula_anonymous": "ABC2",
"energy_above_hull": 3.07928248,
"spacegroup": 166
},
{
"id": "jvasp-29394",
"created_at": "2022-09-04T14:38:06.704570Z",
"updated_at": "2022-09-04T14:38:06.704591Z",
"structure_string": "Tc2 Xe2 O8 F10\n1.0\n5.243437 0.000000 -0.000000\n-0.000000 7.169388 -3.493107\n0.000000 -0.024991 9.052624\nTc Xe O F\n2 2 8 10\ndirect\n0.095550 0.597582 0.195163 Tc\n0.595551 0.402418 0.804836 Tc\n0.450495 0.122753 0.245506 Xe\n0.950496 0.877247 0.754493 Xe\n0.574110 0.366729 0.351918 O\n0.309720 0.358482 0.716965 O\n0.074110 0.014811 0.648081 O\n0.574110 0.985190 0.351918 O\n0.809720 0.641518 0.283034 O\n0.074110 0.633271 0.648081 O\n0.290392 0.677996 0.355992 O\n0.790392 0.322004 0.644007 O\n0.758479 0.038371 0.076744 F\n0.114835 0.800388 0.143977 F\n0.258478 0.961629 0.923255 F\n0.118825 0.190706 0.381412 F\n0.614835 0.199612 0.856022 F\n0.417621 0.519209 0.038417 F\n0.614835 0.656411 0.856022 F\n0.114835 0.343590 0.143977 F\n0.917621 0.480791 0.961582 F\n0.618825 0.809294 0.618588 F\n",
"nsites": 22,
"nelements": 4,
"elements": [
"Tc",
"Xe",
"O",
"F"
],
"chemical_system": "F-O-Tc-Xe",
"density": 3.7943637321614814,
"density_atomic": 0.06473432162972012,
"volume": 339.8506301779116,
"volume_molar": 9.302856055936763,
"formula_full": "Tc2 Xe2 O8 F10",
"formula_reduced": "TcXeO4F5",
"formula_anonymous": "ABC4D5",
"energy_above_hull": 1.314384705681818,
"spacegroup": 36
},
{
"id": "jvasp-14523",
"created_at": "2022-09-04T14:38:06.703496Z",
"updated_at": "2022-09-04T14:38:06.703523Z",
"structure_string": "Np1 Pd3\n1.0\n4.143579 0.000000 -0.000000\n-0.000000 4.143579 -0.000000\n0.000000 0.000000 4.143579\nNp Pd\n1 3\ndirect\n0.000000 0.000000 0.000000 Np\n0.500000 0.000000 0.500000 Pd\n0.000000 0.500000 0.500000 Pd\n0.500000 0.500000 0.000000 Pd\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Np",
"Pd"
],
"chemical_system": "Np-Pd",
"density": 12.983747435168102,
"density_atomic": 0.05622547346484886,
"volume": 71.14213102181749,
"volume_molar": 10.71069817449369,
"formula_full": "Np1 Pd3",
"formula_reduced": "NpPd3",
"formula_anonymous": "AB3",
"energy_above_hull": 2.890949275,
"spacegroup": 221
},
{
"id": "jvasp-37951",
"created_at": "2022-09-04T14:38:06.703049Z",
"updated_at": "2022-09-04T14:38:06.703068Z",
"structure_string": "Co1 Hg3\n1.0\n4.274516 -0.000000 -0.000000\n-0.000000 4.274516 -0.000000\n-0.000000 0.000000 4.274516\nCo Hg\n1 3\ndirect\n0.000000 0.000000 0.000000 Co\n0.000000 0.500000 0.500000 Hg\n0.500000 0.000000 0.500000 Hg\n0.500000 0.500000 0.000000 Hg\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Co",
"Hg"
],
"chemical_system": "Co-Hg",
"density": 14.047358409682102,
"density_atomic": 0.05121523269068475,
"volume": 78.10176367171982,
"volume_molar": 11.75849536088378,
"formula_full": "Co1 Hg3",
"formula_reduced": "CoHg3",
"formula_anonymous": "AB3",
"energy_above_hull": 0.0,
"spacegroup": 221
},
{
"id": "jvasp-29664",
"created_at": "2022-09-04T14:38:06.702985Z",
"updated_at": "2022-09-04T14:38:06.703007Z",
"structure_string": "Nb4 Se8\n1.0\n3.497997 0.000000 0.000000\n-1.748998 3.029353 0.000000\n0.000000 -0.000000 25.335866\nNb Se\n4 8\ndirect\n0.333333 0.666666 0.500000 Nb\n0.000000 0.000000 0.000000 Nb\n0.000000 0.000000 0.248666 Nb\n0.000000 0.000000 0.751334 Nb\n0.333333 0.666666 0.314872 Se\n0.333333 0.666666 0.066162 Se\n0.333333 0.666666 0.685129 Se\n0.666667 0.333333 0.182632 Se\n0.666667 0.333333 0.433787 Se\n0.666667 0.333333 0.566213 Se\n0.333333 0.666666 0.933839 Se\n0.666667 0.333333 0.817369 Se\n",
"nsites": 12,
"nelements": 2,
"elements": [
"Nb",
"Se"
],
"chemical_system": "Nb-Se",
"density": 6.205506429553966,
"density_atomic": 0.04469677378285342,
"volume": 268.47575304424856,
"volume_molar": 13.473323128995528,
"formula_full": "Nb4 Se8",
"formula_reduced": "NbSe2",
"formula_anonymous": "AB2",
"energy_above_hull": 2.1635387111111117,
"spacegroup": 187
},
{
"id": "jvasp-77411",
"created_at": "2022-09-04T14:38:06.700806Z",
"updated_at": "2022-09-04T14:38:06.700827Z",
"structure_string": "Hf1 Mg1 Hg2\n1.0\n-11.225415 2.499006 -2.400135\n-8.086163 1.601601 1.152019\n-7.160912 4.218607 -0.450563\nHf Mg Hg\n1 1 2\ndirect\n0.500000 -0.000001 0.000001 Hf\n0.000000 0.000000 0.000000 Mg\n0.743800 0.004083 0.004086 Hg\n0.256201 -0.004085 -0.004084 Hg\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Hf",
"Mg",
"Hg"
],
"chemical_system": "Hf-Hg-Mg",
"density": 11.490606963205707,
"density_atomic": 0.04582842175532051,
"volume": 87.2820805690437,
"volume_molar": 13.14062437531105,
"formula_full": "Hf1 Mg1 Hg2",
"formula_reduced": "HfMgHg2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.3365228125,
"spacegroup": 12
},
{
"id": "jvasp-46665",
"created_at": "2022-09-04T14:38:06.697603Z",
"updated_at": "2022-09-04T14:38:06.697622Z",
"structure_string": "Li8 Mn2 F14\n1.0\n6.130670 4.362614 -0.112359\n-6.130670 4.362614 0.112359\n-1.211712 0.000000 5.204478\nLi Mn F\n8 2 14\ndirect\n0.250135 0.944278 0.849021 Li\n0.055721 0.749864 0.349021 Li\n0.310540 0.579183 0.771160 Li\n0.420816 0.689459 0.271160 Li\n0.579184 0.310540 0.728841 Li\n0.689459 0.420816 0.228841 Li\n0.944279 0.250135 0.650980 Li\n0.749864 0.055721 0.150980 Li\n0.764917 0.764916 0.750000 Mn\n0.235083 0.235082 0.250000 Mn\n0.604192 0.212341 0.066759 F\n0.787658 0.395807 0.566759 F\n0.843000 0.666774 0.084252 F\n0.333225 0.156999 0.584252 F\n0.450863 0.450863 0.250000 F\n0.549136 0.549136 0.750000 F\n0.184346 0.984860 0.153546 F\n0.156999 0.333225 0.915748 F\n0.212341 0.604191 0.433242 F\n0.395808 0.787658 0.933242 F\n0.815654 0.015139 0.846454 F\n0.015140 0.815653 0.653546 F\n0.666774 0.843000 0.415748 F\n0.984860 0.184345 0.346454 F\n",
"nsites": 24,
"nelements": 3,
"elements": [
"Li",
"Mn",
"F"
],
"chemical_system": "F-Li-Mn",
"density": 2.5840805452280207,
"density_atomic": 0.08657777849291624,
"volume": 277.20738990737294,
"volume_molar": 6.95575800722668,
"formula_full": "Li8 Mn2 F14",
"formula_reduced": "Li4MnF7",
"formula_anonymous": "AB4C7",
"energy_above_hull": 0.3670616015732759,
"spacegroup": 15
},
{
"id": "jvasp-18298",
"created_at": "2022-09-04T14:38:06.696006Z",
"updated_at": "2022-09-04T14:38:06.696034Z",
"structure_string": "Ba2 In4 Ir2\n1.0\n4.410352 -0.000000 -0.000000\n-2.205176 5.862457 0.000000\n-0.000000 0.000000 8.235899\nBa In Ir\n2 4 2\ndirect\n0.944848 0.889700 0.250000 Ba\n0.055150 0.110301 0.750000 Ba\n0.338427 0.676856 0.554379 In\n0.661572 0.323144 0.445622 In\n0.338427 0.676856 0.945622 In\n0.661572 0.323144 0.054379 In\n0.779282 0.558565 0.750000 Ir\n0.220717 0.441435 0.250000 Ir\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Ba",
"In",
"Ir"
],
"chemical_system": "Ba-In-Ir",
"density": 8.72101006464887,
"density_atomic": 0.03756869000811309,
"volume": 212.94327798686544,
"volume_molar": 16.029679924158913,
"formula_full": "Ba2 In4 Ir2",
"formula_reduced": "BaIn2Ir",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.7409392524999999,
"spacegroup": 63
},
{
"id": "jvasp-29719",
"created_at": "2022-09-04T14:38:06.692738Z",
"updated_at": "2022-09-04T14:38:06.692756Z",
"structure_string": "Cu6 Se6\n1.0\n3.940304 0.000000 0.000000\n-1.970152 3.412403 -0.000000\n-0.000000 0.000000 17.662535\nCu Se\n6 6\ndirect\n0.666666 0.333333 0.540312 Cu\n0.333333 0.666666 0.040312 Cu\n0.666666 0.333333 0.959688 Cu\n0.666666 0.333333 0.250000 Cu\n0.333333 0.666666 0.750000 Cu\n0.333333 0.666666 0.459688 Cu\n0.000000 0.000000 0.409813 Se\n0.000000 0.000000 0.909813 Se\n0.000000 0.000000 0.090187 Se\n0.333333 0.666666 0.250000 Se\n0.666666 0.333333 0.750000 Se\n0.000000 0.000000 0.590187 Se\n",
"nsites": 12,
"nelements": 2,
"elements": [
"Cu",
"Se"
],
"chemical_system": "Cu-Se",
"density": 5.978475003963588,
"density_atomic": 0.05052870477938084,
"volume": 237.4887710340998,
"volume_molar": 11.91825673405633,
"formula_full": "Cu6 Se6",
"formula_reduced": "CuSe",
"formula_anonymous": "AB",
"energy_above_hull": 0.3676969083333333,
"spacegroup": 194
},
{
"id": "jvasp-46447",
"created_at": "2022-09-04T14:38:06.692272Z",
"updated_at": "2022-09-04T14:38:06.692297Z",
"structure_string": "Na4 V2 B2 P2 O14\n1.0\n0.000000 5.388947 -0.025106\n6.372298 0.000000 0.000000\n0.000000 -0.400814 -9.062595\nNa V B P O\n4 2 2 2 14\ndirect\n0.766774 -0.001218 0.221207 Na\n0.766774 0.501218 0.221207 Na\n0.233227 0.498783 0.778793 Na\n0.233227 0.001218 0.778793 Na\n0.219954 0.250000 0.335332 V\n0.780047 0.750000 0.664667 V\n0.284735 0.250000 0.076459 B\n0.715266 0.750000 0.923541 B\n0.277226 0.750000 0.438733 P\n0.722775 0.250000 0.561267 P\n0.532872 0.750000 0.802094 O\n0.797514 0.054362 0.655112 O\n0.797514 0.445638 0.655112 O\n0.130448 0.750000 0.580686 O\n0.438602 0.250000 0.526820 O\n0.561399 0.750000 0.473180 O\n0.053597 0.250000 0.148386 O\n0.202488 0.554363 0.344888 O\n0.202488 0.945638 0.344888 O\n0.467129 0.250000 0.197906 O\n0.946404 0.750000 0.851614 O\n0.674346 0.750000 0.063840 O\n0.869553 0.250000 0.419314 O\n0.325655 0.250000 0.936160 O\n",
"nsites": 24,
"nelements": 5,
"elements": [
"Na",
"V",
"B",
"P",
"O"
],
"chemical_system": "B-Na-O-P-V",
"density": 2.674817540831941,
"density_atomic": 0.07710263217048026,
"volume": 311.2734199130067,
"volume_molar": 7.810551456511306,
"formula_full": "Na4 V2 B2 P2 O14",
"formula_reduced": "Na2VBPO7",
"formula_anonymous": "ABCD2E7",
"energy_above_hull": 2.578052898611111,
"spacegroup": 11
}
]
}