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=95",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=nelements&page=93",
"results": [
{
"id": "jvasp-93962",
"created_at": "2022-09-04T14:36:32.116753Z",
"updated_at": "2022-09-04T14:36:32.116780Z",
"structure_string": "Sm1 Co5\n1.0\n0.000000 0.000000 -3.934749\n-2.476380 -4.289216 0.000000\n-2.475579 4.288754 0.000000\nSm Co\n1 5\ndirect\n0.000000 0.999985 -0.000001 Sm\n0.000000 0.333315 0.666712 Co\n0.000000 0.666602 0.333287 Co\n0.500000 0.500016 -0.000000 Co\n0.500000 0.500001 0.500015 Co\n0.500000 0.999986 0.499984 Co\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Sm",
"Co"
],
"chemical_system": "Co-Sm",
"density": 8.842719730479596,
"density_atomic": 0.07179639741691057,
"volume": 83.5696527384087,
"volume_molar": 8.38780353425028,
"formula_full": "Sm1 Co5",
"formula_reduced": "SmCo5",
"formula_anonymous": "AB5",
"energy_above_hull": 3.3044788958333338,
"spacegroup": 191
},
{
"id": "jvasp-78680",
"created_at": "2022-09-04T14:36:32.169728Z",
"updated_at": "2022-09-04T14:36:32.169756Z",
"structure_string": "Gd1 Te1\n1.0\n3.805505 0.000000 2.197109\n1.268501 3.587865 2.197109\n0.000000 0.000000 4.394219\nGd Te\n1 1\ndirect\n0.000000 0.000000 0.000000 Gd\n0.499999 0.500001 0.500001 Te\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Gd",
"Te"
],
"chemical_system": "Gd-Te",
"density": 7.883793371808242,
"density_atomic": 0.033334957643806486,
"volume": 59.99707638361415,
"volume_molar": 18.06554195852981,
"formula_full": "Gd1 Te1",
"formula_reduced": "GdTe",
"formula_anonymous": "AB",
"energy_above_hull": 1.490135633333333,
"spacegroup": 225
},
{
"id": "jvasp-100006",
"created_at": "2022-09-04T14:36:32.192845Z",
"updated_at": "2022-09-04T14:36:32.192881Z",
"structure_string": "Cu3 Ge1\n1.0\n2.747934 0.000000 0.000000\n-1.373967 2.379780 -0.000000\n-0.000000 -0.000000 8.330493\nCu Ge\n3 1\ndirect\n0.333332 0.666667 0.500000 Cu\n0.000000 0.000000 0.739609 Cu\n0.000000 0.000000 0.260391 Cu\n0.333332 0.666667 0.000000 Ge\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Cu",
"Ge"
],
"chemical_system": "Cu-Ge",
"density": 8.025088969987614,
"density_atomic": 0.07342537607470434,
"volume": 54.47707882259024,
"volume_molar": 8.201715921581338,
"formula_full": "Cu3 Ge1",
"formula_reduced": "Cu3Ge",
"formula_anonymous": "AB3",
"energy_above_hull": 0.0372975,
"spacegroup": 187
},
{
"id": "jvasp-99388",
"created_at": "2022-09-04T14:36:32.078122Z",
"updated_at": "2022-09-04T14:36:32.078142Z",
"structure_string": "Mg5 Ag1\n1.0\n4.772356 -0.002742 3.387771\n1.748207 4.440626 3.387771\n-0.004028 -0.002742 5.852552\nMg Ag\n5 1\ndirect\n0.657876 0.342125 -0.000001 Mg\n-0.000000 0.657876 0.342124 Mg\n0.342125 0.000000 0.657875 Mg\n0.165175 0.165175 0.165174 Mg\n0.834826 0.834827 0.834824 Mg\n0.500000 0.500001 0.499999 Ag\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Mg",
"Ag"
],
"chemical_system": "Ag-Mg",
"density": 3.0683055307399196,
"density_atomic": 0.048330380692682674,
"volume": 124.1455149743609,
"volume_molar": 12.460362764971485,
"formula_full": "Mg5 Ag1",
"formula_reduced": "Mg5Ag",
"formula_anonymous": "AB5",
"energy_above_hull": 0.0007683333333333,
"spacegroup": 155
},
{
"id": "jvasp-14650",
"created_at": "2022-09-04T14:36:32.074126Z",
"updated_at": "2022-09-04T14:36:32.074141Z",
"structure_string": "Th1 Ir5\n1.0\n2.672268 -4.628504 0.000000\n2.672268 4.628504 -0.000000\n-0.000000 -0.000000 4.378668\nTh Ir\n1 5\ndirect\n0.000000 0.000000 0.000000 Th\n0.333334 0.666667 0.000000 Ir\n0.666667 0.333334 0.000000 Ir\n0.500000 0.500000 0.500000 Ir\n0.500000 0.000000 0.500000 Ir\n0.000000 0.500000 0.500000 Ir\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Th",
"Ir"
],
"chemical_system": "Ir-Th",
"density": 18.291177726836,
"density_atomic": 0.05539347147070449,
"volume": 108.31601343442021,
"volume_molar": 10.87157132440216,
"formula_full": "Th1 Ir5",
"formula_reduced": "ThIr5",
"formula_anonymous": "AB5",
"energy_above_hull": 4.823438516666667,
"spacegroup": 191
},
{
"id": "jvasp-95456",
"created_at": "2022-09-04T14:36:32.049355Z",
"updated_at": "2022-09-04T14:36:32.049384Z",
"structure_string": "H24 O12\n1.0\n3.937008 -0.001740 0.000330\n0.003500 8.041685 0.000698\n-0.000713 -0.000708 8.104867\nH O\n24 12\ndirect\n0.486174 0.923573 0.649011 H\n0.513481 0.346798 0.928583 H\n0.561103 0.780689 0.775952 H\n0.736610 0.846797 0.071455 H\n0.954366 0.277612 0.718489 H\n0.986182 0.576407 0.851034 H\n0.263919 0.076396 0.149007 H\n0.644676 0.541743 0.600144 H\n0.105432 0.458238 0.100148 H\n0.892972 0.907454 0.448434 H\n0.295734 0.777613 0.281547 H\n0.795730 0.722375 0.218496 H\n0.357131 0.407462 0.551612 H\n0.454367 0.222375 0.781541 H\n0.144666 0.958246 0.899893 H\n0.188991 0.219280 0.275951 H\n0.763925 0.423565 0.351029 H\n0.392974 0.592520 0.051615 H\n0.236629 0.653191 0.428585 H\n0.061112 0.719290 0.724095 H\n0.688996 0.280680 0.224096 H\n0.013477 0.153184 0.571457 H\n0.857119 0.092523 0.948425 H\n0.605417 0.041728 0.399897 H\n0.250144 0.499623 0.007370 O\n0.383028 0.864070 0.745375 O\n0.629142 0.256460 0.864202 O\n0.867084 0.364054 0.254671 O\n0.120944 0.743515 0.364195 O\n-0.000046 0.999629 0.992671 O\n0.620962 0.756448 0.135827 O\n0.750144 0.000353 0.492675 O\n0.499993 0.500344 0.507361 O\n0.129144 0.243528 0.635830 O\n0.367078 0.135907 0.245365 O\n0.883030 0.635914 0.754673 O\n",
"nsites": 36,
"nelements": 2,
"elements": [
"H",
"O"
],
"chemical_system": "H-O",
"density": 1.3989816652511387,
"density_atomic": 0.14029531339584528,
"volume": 256.60158652930534,
"volume_molar": 4.292474648107768,
"formula_full": "H24 O12",
"formula_reduced": "H2O",
"formula_anonymous": "AB2",
"energy_above_hull": 1.904667833333333,
"spacegroup": 19
},
{
"id": "jvasp-28414",
"created_at": "2022-09-04T14:36:32.144800Z",
"updated_at": "2022-09-04T14:36:32.144832Z",
"structure_string": "Mo2 Se4\n1.0\n3.326125 0.000000 0.000000\n-1.663063 2.880509 -0.000000\n0.000000 0.000000 22.266239\nMo Se\n2 4\ndirect\n0.666668 0.333333 0.451398 Mo\n0.333334 0.666667 0.155697 Mo\n0.333334 0.666667 0.526488 Se\n0.666668 0.333333 0.230888 Se\n0.333334 0.666667 0.376207 Se\n0.666668 0.333333 0.080607 Se\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Mo",
"Se"
],
"chemical_system": "Mo-Se",
"density": 3.9520160479568474,
"density_atomic": 0.02812526227227568,
"volume": 213.33134396810468,
"volume_molar": 21.411856364931722,
"formula_full": "Mo2 Se4",
"formula_reduced": "MoSe2",
"formula_anonymous": "AB2",
"energy_above_hull": 2.3838242111111105,
"spacegroup": 164
},
{
"id": "jvasp-11302",
"created_at": "2022-09-04T14:36:32.233922Z",
"updated_at": "2022-09-04T14:36:32.233940Z",
"structure_string": "Cr2 F10\n1.0\n5.203657 0.692458 -0.231623\n2.375387 4.682944 -0.221316\n2.440083 1.716619 6.431747\nCr F\n2 10\ndirect\n0.001469 0.000136 0.001185 Cr\n0.001464 0.000141 0.501181 Cr\n0.854694 0.146802 0.751162 F\n0.148234 0.853447 0.251198 F\n0.965378 0.672176 0.631199 F\n0.329443 0.036211 0.871142 F\n0.210298 0.611739 0.963871 F\n0.389880 0.791247 0.538697 F\n0.792650 0.388536 0.038493 F\n0.613066 0.209041 0.463632 F\n0.673486 0.964077 0.131225 F\n0.037568 0.328092 0.371143 F\n",
"nsites": 12,
"nelements": 2,
"elements": [
"Cr",
"F"
],
"chemical_system": "Cr-F",
"density": 3.266205385581863,
"density_atomic": 0.08029036275221638,
"volume": 149.45753872146688,
"volume_molar": 7.500452798531866,
"formula_full": "Cr2 F10",
"formula_reduced": "CrF5",
"formula_anonymous": "AB5",
"energy_above_hull": 0.3732598020833333,
"spacegroup": 15
},
{
"id": "jvasp-7565",
"created_at": "2022-09-04T14:36:32.224264Z",
"updated_at": "2022-09-04T14:36:32.224274Z",
"structure_string": "H1 S1\n1.0\n20.000000 0.000000 0.000000\n0.000000 20.000000 0.000000\n0.000000 0.000000 21.344413\nH S\n1 1\ndirect\n0.500000 0.500000 0.468363 H\n0.500000 0.500000 0.531637 S\n",
"nsites": 2,
"nelements": 2,
"elements": [
"H",
"S"
],
"chemical_system": "H-S",
"density": 0.00643246887573317,
"density_atomic": 0.00023425333833261192,
"volume": 8537.7652,
"volume_molar": 2570.7811905114777,
"formula_full": "H1 S1",
"formula_reduced": "HS",
"formula_anonymous": "AB",
"energy_above_hull": 1.92958,
"spacegroup": 99
},
{
"id": "jvasp-99768",
"created_at": "2022-09-04T14:36:32.496705Z",
"updated_at": "2022-09-04T14:36:32.496740Z",
"structure_string": "Ga3 Sn1\n1.0\n4.173217 0.071245 -3.209714\n-0.970050 4.059534 -3.209714\n-0.055246 -0.071245 5.264498\nGa Sn\n3 1\ndirect\n0.750000 0.249999 0.500000 Ga\n0.250000 0.750000 0.500000 Ga\n0.500000 0.499999 0.000000 Ga\n0.000000 0.000000 0.000000 Sn\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Ga",
"Sn"
],
"chemical_system": "Ga-Sn",
"density": 6.210428938222134,
"density_atomic": 0.04562668211001706,
"volume": 87.66800071841789,
"volume_molar": 13.198726011852342,
"formula_full": "Ga3 Sn1",
"formula_reduced": "Ga3Sn",
"formula_anonymous": "AB3",
"energy_above_hull": 0.0,
"spacegroup": 139
},
{
"id": "jvasp-78276",
"created_at": "2022-09-04T14:36:31.980067Z",
"updated_at": "2022-09-04T14:36:31.980092Z",
"structure_string": "Yb1 Ag2\n1.0\n3.701502 -0.000000 0.000000\n-0.000000 3.701502 0.000000\n-1.850752 -1.850752 4.593715\nYb Ag\n1 2\ndirect\n0.000000 0.000000 0.000000 Yb\n0.670011 0.670011 0.340022 Ag\n0.329989 0.329989 0.659977 Ag\n",
"nsites": 3,
"nelements": 2,
"elements": [
"Yb",
"Ag"
],
"chemical_system": "Ag-Yb",
"density": 10.257203388592549,
"density_atomic": 0.04766517923778281,
"volume": 62.93902693692142,
"volume_molar": 12.634255983719083,
"formula_full": "Yb1 Ag2",
"formula_reduced": "YbAg2",
"formula_anonymous": "AB2",
"energy_above_hull": 0.0325381609195402,
"spacegroup": 139
},
{
"id": "jvasp-14310",
"created_at": "2022-09-04T14:36:31.969551Z",
"updated_at": "2022-09-04T14:36:31.969576Z",
"structure_string": "Pu4 Si4\n1.0\n3.866853 0.000000 0.000000\n-0.000000 5.657819 0.000000\n0.000000 0.000000 8.045818\nPu Si\n4 4\ndirect\n0.250000 0.389938 0.682075 Pu\n0.749999 0.610063 0.317925 Pu\n0.749999 0.889938 0.817925 Pu\n0.250000 0.110062 0.182075 Pu\n0.250000 0.874688 0.531279 Si\n0.749999 0.125312 0.468722 Si\n0.749999 0.374688 0.968722 Si\n0.250000 0.625312 0.031278 Si\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Pu",
"Si"
],
"chemical_system": "Pu-Si",
"density": 10.266858346854045,
"density_atomic": 0.04544782147457513,
"volume": 176.02603910234595,
"volume_molar": 13.250669811244894,
"formula_full": "Pu4 Si4",
"formula_reduced": "PuSi",
"formula_anonymous": "AB",
"energy_above_hull": 3.4957293,
"spacegroup": 62
}
]
}