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=volume&page=4113",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=volume&page=4111",
"results": [
{
"id": "jvasp-20392",
"created_at": "2022-09-04T14:37:47.174144Z",
"updated_at": "2022-09-04T14:37:47.174163Z",
"structure_string": "Yb4 Mg8\n1.0\n3.087312 -5.347383 0.000000\n3.087312 5.347383 -0.000000\n-0.000000 -0.000000 9.997388\nYb Mg\n4 8\ndirect\n0.666667 0.333333 0.061024 Yb\n0.333333 0.666667 0.561024 Yb\n0.333333 0.666667 0.938976 Yb\n0.666667 0.333333 0.438976 Yb\n0.168750 0.337500 0.250000 Mg\n0.337500 0.168750 0.750000 Mg\n0.831249 0.168750 0.750000 Mg\n0.168750 0.831249 0.250000 Mg\n0.000000 0.000000 0.000000 Mg\n0.000000 0.000000 0.500000 Mg\n0.831249 0.662499 0.750000 Mg\n0.662499 0.831249 0.250000 Mg\n",
"nsites": 12,
"nelements": 2,
"elements": [
"Yb",
"Mg"
],
"chemical_system": "Mg-Yb",
"density": 4.460037079021514,
"density_atomic": 0.036353220519695945,
"volume": 330.0945508665037,
"volume_molar": 16.565632078558878,
"formula_full": "Yb4 Mg8",
"formula_reduced": "YbMg2",
"formula_anonymous": "AB2",
"energy_above_hull": 0.0840357142857142,
"spacegroup": 194
},
{
"id": "jvasp-44540",
"created_at": "2022-09-04T14:38:31.301465Z",
"updated_at": "2022-09-04T14:38:31.301504Z",
"structure_string": "K2 Hf2 P2 C2 O14\n1.0\n0.000000 5.295937 -0.395681\n6.594829 0.000000 0.000000\n0.000000 0.600395 -9.496324\nK Hf P C O\n2 2 2 2 14\ndirect\n0.918017 0.628084 0.140667 K\n0.081984 0.128084 0.859332 K\n0.266047 0.230466 0.336675 Hf\n0.733955 0.730466 0.663324 Hf\n0.295892 0.733106 0.435285 P\n0.704109 0.233106 0.564714 P\n0.475859 0.244584 0.076359 C\n0.524142 0.744584 0.923640 C\n0.394436 0.753214 0.814069 O\n0.736625 0.420881 0.656051 O\n0.743877 0.044471 0.653377 O\n0.099486 0.737281 0.570502 O\n0.436693 0.230704 0.518054 O\n0.563309 0.730704 0.481945 O\n0.605565 0.253214 0.185930 O\n0.256124 0.544471 0.346622 O\n0.263376 0.920881 0.343948 O\n0.777854 0.742609 0.880341 O\n0.222147 0.242609 0.119659 O\n0.430542 0.736750 0.050008 O\n0.900516 0.237281 0.429497 O\n0.569458 0.236750 -0.050008 O\n",
"nsites": 22,
"nelements": 5,
"elements": [
"K",
"Hf",
"P",
"C",
"O"
],
"chemical_system": "C-Hf-K-O-P",
"density": 3.748346848844665,
"density_atomic": 0.06664647025083764,
"volume": 330.10000255375104,
"volume_molar": 9.035948546613856,
"formula_full": "K2 Hf2 P2 C2 O14",
"formula_reduced": "KHfPCO7",
"formula_anonymous": "ABCDE7",
"energy_above_hull": 3.1214264545454533,
"spacegroup": 4
},
{
"id": "jvasp-57158",
"created_at": "2022-09-04T14:37:32.164441Z",
"updated_at": "2022-09-04T14:37:32.164473Z",
"structure_string": "Zr2 Tl2 Cd2 F14\n1.0\n6.561040 0.028554 -0.000000\n-2.966624 5.852111 -0.000000\n0.000000 -0.000000 8.578411\nZr Tl Cd F\n2 2 2 14\ndirect\n0.192455 0.807545 0.250000 Zr\n0.807545 0.192454 0.750000 Zr\n0.500000 0.500000 0.000000 Tl\n0.500000 0.500000 0.500000 Tl\n0.807647 0.192352 0.250000 Cd\n0.192353 0.807647 0.750000 Cd\n0.172241 0.474241 0.250000 F\n0.202807 0.797193 0.486461 F\n0.525759 0.827759 0.250000 F\n0.564193 0.845014 0.750000 F\n0.474241 0.172240 0.750000 F\n0.827759 0.525758 0.750000 F\n0.154986 0.435807 0.750000 F\n0.797193 0.202807 0.513539 F\n0.009223 0.990778 0.250000 F\n0.435807 0.154986 0.250000 F\n0.845014 0.564192 0.250000 F\n0.797193 0.202807 0.986461 F\n0.202807 0.797193 0.013539 F\n0.990777 0.009222 0.750000 F\n",
"nsites": 20,
"nelements": 4,
"elements": [
"Zr",
"Tl",
"Cd",
"F"
],
"chemical_system": "Cd-F-Tl-Zr",
"density": 5.442931914338443,
"density_atomic": 0.06058719153485542,
"volume": 330.1027740903641,
"volume_molar": 9.939626854193268,
"formula_full": "Zr2 Tl2 Cd2 F14",
"formula_reduced": "ZrTlCdF7",
"formula_anonymous": "ABCD7",
"energy_above_hull": 0.0,
"spacegroup": 63
},
{
"id": "jvasp-56439",
"created_at": "2022-09-04T14:37:07.899151Z",
"updated_at": "2022-09-04T14:37:07.899178Z",
"structure_string": "Np6 Se8\n1.0\n7.109834 -0.000000 -2.513706\n-3.554917 6.157297 -2.513706\n0.000000 0.000000 7.541118\nNp Se\n6 8\ndirect\n0.125000 0.750000 0.875000 Np\n0.625000 0.375000 0.249999 Np\n0.375000 0.250000 0.625000 Np\n0.749999 0.875000 0.124999 Np\n0.250000 0.625000 0.375000 Np\n0.874999 0.125000 0.750000 Np\n0.649454 0.649455 0.649454 Se\n-0.000000 0.850546 0.500000 Se\n0.850545 0.500000 -0.000001 Se\n-0.000000 0.350546 0.500000 Se\n0.500000 -0.000000 0.850545 Se\n0.500000 -0.000000 0.350545 Se\n0.350545 0.500000 -0.000000 Se\n0.149454 0.149455 0.149454 Se\n",
"nsites": 14,
"nelements": 2,
"elements": [
"Np",
"Se"
],
"chemical_system": "Np-Se",
"density": 10.329910797071735,
"density_atomic": 0.04240750634548257,
"volume": 330.13023416056956,
"volume_molar": 14.200648137476504,
"formula_full": "Np6 Se8",
"formula_reduced": "Np3Se4",
"formula_anonymous": "A3B4",
"energy_above_hull": 4.182830495238095,
"spacegroup": 220
},
{
"id": "jvasp-119535",
"created_at": "2022-09-04T14:38:51.186834Z",
"updated_at": "2022-09-04T14:38:51.186860Z",
"structure_string": "V6 H6 O18\n1.0\n5.137979 0.066769 0.084533\n1.211924 7.754378 -0.660559\n-0.163171 -0.777917 8.371552\nV H O\n6 6 18\ndirect\n0.484866 0.816149 0.441290 V\n0.583309 0.182277 0.998092 V\n0.588024 0.187157 0.607245 V\n0.485591 0.804700 0.045349 V\n0.967081 0.930561 0.259770 V\n0.110108 0.068436 0.785461 V\n0.889845 0.606100 0.624897 H\n-0.021709 0.416539 0.682628 H\n0.832913 0.568690 0.221066 H\n0.202013 0.497271 0.600850 H\n-0.056530 0.363141 0.115853 H\n0.154283 0.462768 0.219352 H\n0.446575 0.258681 0.815945 O\n0.613441 0.648298 0.904020 O\n0.450352 0.341260 0.514110 O\n0.458392 0.337176 0.144744 O\n0.623116 0.669696 0.543363 O\n0.930322 0.916938 0.755281 O\n0.135148 0.088382 0.285528 O\n0.636512 0.730319 0.233153 O\n0.350690 0.012189 0.610695 O\n0.907589 0.233366 0.666277 O\n0.908187 0.222957 0.966413 O\n0.167272 0.775057 0.389502 O\n0.715680 0.986468 0.107821 O\n-0.036108 0.451410 0.218911 O\n0.356137 0.000821 0.933876 O\n0.714657 0.994094 0.435056 O\n0.165722 0.770108 0.090983 O\n0.041074 0.533321 0.674471 O\n",
"nsites": 30,
"nelements": 3,
"elements": [
"V",
"H",
"O"
],
"chemical_system": "H-O-V",
"density": 3.0152529394039473,
"density_atomic": 0.09083895144682473,
"volume": 330.2548028371,
"volume_molar": 6.629469697836878,
"formula_full": "V6 H6 O18",
"formula_reduced": "VHO3",
"formula_anonymous": "ABC3",
"energy_above_hull": 2.62238894,
"spacegroup": 1
},
{
"id": "jvasp-28844",
"created_at": "2022-09-04T14:37:05.999295Z",
"updated_at": "2022-09-04T14:37:05.999333Z",
"structure_string": "Mo2 W2 Se6 S2\n1.0\n3.290967 0.000005 -0.000013\n-1.645479 2.850052 0.000269\n-0.000148 0.003287 35.212271\nMo W Se S\n2 2 6 2\ndirect\n0.333321 0.666641 0.094282 Mo\n0.666686 0.333371 0.282055 Mo\n0.333316 0.666631 0.470941 W\n0.666677 0.333359 0.655642 W\n0.333214 0.666428 0.329902 Se\n0.666667 0.333347 0.046490 Se\n0.666636 0.333278 0.422766 Se\n0.666631 0.333251 0.142165 Se\n0.666666 0.333324 0.519113 Se\n0.333480 0.666959 0.234159 Se\n0.333321 0.666635 0.699419 S\n0.333380 0.666764 0.611813 S\n",
"nsites": 12,
"nelements": 4,
"elements": [
"Mo",
"W",
"Se",
"S"
],
"chemical_system": "Mo-S-Se-W",
"density": 5.5177639336266076,
"density_atomic": 0.03633377495127857,
"volume": 330.2712150359077,
"volume_molar": 16.574497882687204,
"formula_full": "Mo2 W2 Se6 S2",
"formula_reduced": "MoWSe3S",
"formula_anonymous": "ABCD3",
"energy_above_hull": 3.591847666666666,
"spacegroup": 156
},
{
"id": "jvasp-33308",
"created_at": "2022-09-04T14:38:34.452366Z",
"updated_at": "2022-09-04T14:38:34.452394Z",
"structure_string": "B4 H20 C4 N8\n1.0\n7.722402 0.000000 0.000000\n0.000000 6.382985 0.000000\n0.000000 0.000000 6.701021\nB H C N\n4 20 4 8\ndirect\n0.727833 0.127310 0.652195 B\n0.272166 0.872691 0.152195 B\n0.772166 0.627310 0.152195 B\n0.227833 0.372691 0.652195 B\n0.308914 0.369050 0.496605 H\n0.691085 0.630951 -0.003394 H\n0.191085 0.869050 -0.003394 H\n0.808914 0.130950 0.496605 H\n0.175445 0.198819 0.695809 H\n0.824554 0.801182 0.195809 H\n0.675445 0.301182 0.695809 H\n0.280733 0.461296 0.961036 H\n0.719267 0.538704 0.461037 H\n0.324554 0.698819 0.195809 H\n0.780733 0.038704 0.961036 H\n0.453943 0.361071 0.849629 H\n0.546057 0.638930 0.349629 H\n0.046057 0.861071 0.349629 H\n0.953943 0.138929 0.849629 H\n0.392235 0.605619 0.794360 H\n0.607765 0.394382 0.294360 H\n0.107765 0.105618 0.294360 H\n0.892234 0.894383 0.794360 H\n0.219267 0.961297 0.461037 H\n0.069982 0.527907 0.632102 C\n0.930018 0.472093 0.132102 C\n0.569981 0.972094 0.632102 C\n0.430018 0.027907 0.132102 C\n0.046796 0.356898 0.118593 N\n0.847831 0.043633 0.827669 N\n0.152169 0.956368 0.327669 N\n0.652169 0.543633 0.327669 N\n0.347831 0.456368 0.827669 N\n0.453204 0.856898 0.618593 N\n0.546796 0.143102 0.118593 N\n0.953204 0.643103 0.618593 N\n",
"nsites": 36,
"nelements": 4,
"elements": [
"B",
"H",
"C",
"N"
],
"chemical_system": "B-C-H-N",
"density": 1.123589991334829,
"density_atomic": 0.10898965862992736,
"volume": 330.30656717842766,
"volume_molar": 5.525424004169131,
"formula_full": "B4 H20 C4 N8",
"formula_reduced": "BH5CN2",
"formula_anonymous": "ABC2D5",
"energy_above_hull": 4.404054342592593,
"spacegroup": 33
},
{
"id": "jvasp-119021",
"created_at": "2022-09-04T14:38:51.184380Z",
"updated_at": "2022-09-04T14:38:51.184404Z",
"structure_string": "Dy4 Si10 Rh6\n1.0\n7.667109 0.000264 2.650977\n-1.398609 7.538465 2.650977\n0.005803 0.006979 5.720199\nDy Si Rh\n4 10 6\ndirect\n0.866369 0.598707 0.762793 Dy\n0.401292 0.133631 0.737209 Dy\n0.133631 0.401292 0.237209 Dy\n0.598707 0.866368 0.262793 Dy\n0.224255 0.775744 0.250001 Si\n0.775745 0.224255 0.750001 Si\n0.489233 0.510766 0.250001 Si\n0.510766 0.489233 0.750001 Si\n0.788476 0.211523 0.250001 Si\n0.265504 0.057845 0.337723 Si\n0.942155 0.734495 0.162279 Si\n0.734495 0.942154 0.662279 Si\n0.057845 0.265504 0.837723 Si\n0.211523 0.788476 0.750001 Si\n0.002118 0.997881 0.750001 Rh\n0.258035 0.538119 0.624517 Rh\n0.461880 0.741964 0.875485 Rh\n0.741964 0.461880 0.375485 Rh\n0.538120 0.258035 0.124517 Rh\n0.997882 0.002118 0.250001 Rh\n",
"nsites": 20,
"nelements": 3,
"elements": [
"Dy",
"Si",
"Rh"
],
"chemical_system": "Dy-Rh-Si",
"density": 7.782966897577787,
"density_atomic": 0.060544449358040944,
"volume": 330.3358146297814,
"volume_molar": 9.946643868849055,
"formula_full": "Dy4 Si10 Rh6",
"formula_reduced": "Dy2Si5Rh3",
"formula_anonymous": "A2B3C5",
"energy_above_hull": 3.1630145,
"spacegroup": 15
},
{
"id": "jvasp-110722",
"created_at": "2022-09-04T14:38:37.811556Z",
"updated_at": "2022-09-04T14:38:37.811571Z",
"structure_string": "Rb2 Y1 Hg1 Cl6\n1.0\n6.719801 -0.000000 3.879679\n2.239934 6.335489 3.879679\n-0.000000 -0.000000 7.759358\nRb Y Hg Cl\n2 1 1 6\ndirect\n0.749999 0.750000 0.750001 Rb\n0.250000 0.250000 0.250000 Rb\n0.000000 0.000000 0.000000 Y\n0.500000 0.500000 0.500000 Hg\n0.761888 0.238112 0.238112 Cl\n0.238112 0.238112 0.761888 Cl\n0.238112 0.761888 0.761889 Cl\n0.238112 0.761888 0.238112 Cl\n0.761888 0.238112 0.761888 Cl\n0.761887 0.761888 0.238113 Cl\n",
"nsites": 10,
"nelements": 4,
"elements": [
"Rb",
"Y",
"Hg",
"Cl"
],
"chemical_system": "Cl-Hg-Rb-Y",
"density": 3.3837498516895947,
"density_atomic": 0.03027175898390151,
"volume": 330.3408964546127,
"volume_molar": 19.893593772342623,
"formula_full": "Rb2 Y1 Hg1 Cl6",
"formula_reduced": "Rb2YHgCl6",
"formula_anonymous": "ABC2D6",
"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-98880",
"created_at": "2022-09-04T14:35:49.238195Z",
"updated_at": "2022-09-04T14:35:49.238213Z",
"structure_string": "Ba4 Al4 H20\n1.0\n9.207352 0.000000 0.000000\n0.000000 7.042981 0.000000\n0.000000 0.000000 5.094183\nBa Al H\n4 4 20\ndirect\n0.186008 0.345454 0.253997 Ba\n0.813991 0.654545 0.753997 Ba\n0.313991 0.845454 0.753997 Ba\n0.686008 0.154545 0.253997 Ba\n0.540951 0.654210 0.228981 Al\n0.459049 0.345790 0.728981 Al\n0.959048 0.154210 0.728981 Al\n0.040951 0.845790 0.228981 Al\n0.578307 0.788084 0.501913 H\n0.859346 0.803876 0.234459 H\n0.140654 0.196124 0.734459 H\n0.793695 0.043971 0.714497 H\n0.359346 0.696124 0.234459 H\n0.206305 0.956029 0.214497 H\n0.421693 0.211915 0.001913 H\n0.640654 0.303876 0.734459 H\n0.921693 0.288084 0.001913 H\n0.916271 0.343605 0.523827 H\n0.583729 0.843605 0.023828 H\n0.416271 0.156395 0.523827 H\n0.293695 0.456029 0.714497 H\n0.083729 0.656395 0.023828 H\n0.007157 0.948692 0.909324 H\n0.992843 0.051307 0.409324 H\n0.492843 0.448692 0.409324 H\n0.507157 0.551307 0.909324 H\n0.078307 0.711915 0.501913 H\n0.706305 0.543971 0.214497 H\n",
"nsites": 28,
"nelements": 3,
"elements": [
"Ba",
"Al",
"H"
],
"chemical_system": "Al-Ba-H",
"density": 3.405053712328238,
"density_atomic": 0.08476024934965735,
"volume": 330.34353030856425,
"volume_molar": 7.104911566691072,
"formula_full": "Ba4 Al4 H20",
"formula_reduced": "BaAlH5",
"formula_anonymous": "ABC5",
"energy_above_hull": 2.2685741100000003,
"spacegroup": 33
},
{
"id": "jvasp-109920",
"created_at": "2022-09-04T14:37:58.006061Z",
"updated_at": "2022-09-04T14:37:58.006090Z",
"structure_string": "Ac6 Y2\n1.0\n7.810732 0.000000 0.000000\n-3.905366 6.764293 0.000000\n-0.000000 -0.000000 6.253339\nAc Y\n6 2\ndirect\n0.169599 0.339199 0.250000 Ac\n0.660800 0.830400 0.250000 Ac\n0.169599 0.830400 0.250000 Ac\n0.830400 0.660801 0.750000 Ac\n0.339199 0.169599 0.750000 Ac\n0.830400 0.169599 0.750000 Ac\n0.333333 0.666666 0.750000 Y\n0.666666 0.333333 0.250000 Y\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Ac",
"Y"
],
"chemical_system": "Ac-Y",
"density": 7.73910238205537,
"density_atomic": 0.02421385104004328,
"volume": 330.38941169540215,
"volume_molar": 24.87064428554127,
"formula_full": "Ac6 Y2",
"formula_reduced": "Ac3Y",
"formula_anonymous": "AB3",
"energy_above_hull": 1.2904838625,
"spacegroup": 194
},
{
"id": "jvasp-112705",
"created_at": "2022-09-04T14:38:41.852794Z",
"updated_at": "2022-09-04T14:38:41.852822Z",
"structure_string": "Ba4 Bi1 Pb3 O12\n1.0\n4.352488 0.000000 0.000000\n0.000000 4.352488 0.000000\n-0.000000 -0.000000 17.440280\nBa Bi Pb O\n4 1 3 12\ndirect\n0.500000 0.500000 0.869680 Ba\n0.500000 0.500000 0.623118 Ba\n0.500000 0.500000 0.376882 Ba\n0.500000 0.500000 0.130320 Ba\n0.000000 0.000000 0.000000 Bi\n0.000000 0.000000 0.749082 Pb\n0.000000 0.000000 0.500000 Pb\n0.000000 0.000000 0.250918 Pb\n0.000000 0.000000 0.625444 O\n0.000000 0.000000 0.876256 O\n0.500000 -0.000000 -0.000000 O\n0.500000 -0.000000 0.246374 O\n0.500000 -0.000000 0.500000 O\n-0.000000 0.500000 0.500000 O\n-0.000000 0.500000 -0.000000 O\n-0.000000 0.500000 0.246374 O\n0.000000 0.000000 0.374556 O\n-0.000000 0.500000 0.753626 O\n0.500000 -0.000000 0.753626 O\n0.000000 0.000000 0.123744 O\n",
"nsites": 20,
"nelements": 4,
"elements": [
"Ba",
"Bi",
"Pb",
"O"
],
"chemical_system": "Ba-Bi-O-Pb",
"density": 7.900238441958628,
"density_atomic": 0.06053427950086727,
"volume": 330.3913115826127,
"volume_molar": 9.948314921157559,
"formula_full": "Ba4 Bi1 Pb3 O12",
"formula_reduced": "Ba4Bi(PbO4)3",
"formula_anonymous": "AB3C4D12",
"energy_above_hull": 1.774356632,
"spacegroup": 123
}
]
}