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=-chemical_system&page=4445",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-chemical_system&page=4443",
"results": [
{
"id": "jvasp-114879",
"created_at": "2022-09-04T14:38:43.612498Z",
"updated_at": "2022-09-04T14:38:43.612518Z",
"structure_string": "Al1 B1 H2\n1.0\n2.809925 0.000000 0.000000\n0.000000 2.809925 -0.000000\n-0.000000 -0.000000 5.446750\nAl B H\n1 1 2\ndirect\n0.499999 0.499999 0.669642 Al\n0.000000 0.000000 0.870769 B\n0.000000 0.000000 0.088793 H\n0.499999 0.499999 0.380796 H\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Al",
"B",
"H"
],
"chemical_system": "Al-B-H",
"density": 1.5370823098246253,
"density_atomic": 0.09301073851417632,
"volume": 43.00578690051296,
"volume_molar": 6.474672555236329,
"formula_full": "Al1 B1 H2",
"formula_reduced": "AlBH2",
"formula_anonymous": "ABC2",
"energy_above_hull": 2.8866938458333333,
"spacegroup": 99
},
{
"id": "jvasp-32781",
"created_at": "2022-09-04T14:37:51.357010Z",
"updated_at": "2022-09-04T14:37:51.357035Z",
"structure_string": "Al4 B12 H48\n1.0\n5.902817 0.000000 0.000000\n0.000000 5.902740 0.000000\n0.000000 0.000000 17.489135\nAl B H\n4 12 48\ndirect\n0.798701 0.833465 0.138037 Al\n0.298701 0.166535 0.861964 Al\n0.798701 0.666535 0.638037 Al\n0.298701 0.333465 0.361964 Al\n0.400468 0.508632 0.259035 B\n0.400468 0.991368 0.759035 B\n0.464533 0.043651 0.408846 B\n0.964533 0.543651 0.091154 B\n0.464533 0.456349 0.908846 B\n0.964533 0.956349 0.591154 B\n0.006516 0.039287 0.921128 B\n0.506516 0.960713 0.078872 B\n0.006516 0.460713 0.421128 B\n0.900468 0.491368 0.740965 B\n0.506516 0.539287 0.578872 B\n0.900468 0.008632 0.240965 B\n0.016360 0.002974 0.179665 H\n0.491464 0.244435 0.434091 H\n0.491464 0.255565 0.934092 H\n0.516404 0.424530 0.210276 H\n0.365842 0.424560 0.610041 H\n0.489231 0.912388 0.012538 H\n0.692575 0.432210 0.585727 H\n0.989231 0.412388 0.487462 H\n0.489231 0.587612 0.512538 H\n0.830770 0.449310 0.050171 H\n0.016360 0.497026 0.679665 H\n0.991465 0.755565 0.565909 H\n0.512601 0.773446 0.114951 H\n0.726807 0.617330 0.735765 H\n0.512601 0.726554 0.614951 H\n0.880417 0.949721 0.658358 H\n0.380417 0.449721 0.841643 H\n0.226807 0.117330 0.764235 H\n0.880417 0.550279 0.158358 H\n0.192575 0.567790 0.414273 H\n0.152240 0.469517 0.099317 H\n0.833378 0.199488 0.248145 H\n0.016403 0.924530 0.289724 H\n0.865843 0.924560 0.889960 H\n0.333378 0.800512 0.751855 H\n0.012601 0.226554 0.885049 H\n0.152240 0.030483 0.599317 H\n0.192575 0.932210 0.914274 H\n0.516360 0.502974 0.320335 H\n0.833378 0.300512 0.748145 H\n0.692575 0.067790 0.085727 H\n0.726807 0.882670 0.235765 H\n0.012601 0.273446 0.385049 H\n0.226807 0.382670 0.264235 H\n0.330770 0.550690 0.949829 H\n0.333378 0.699488 0.251855 H\n0.365842 0.075440 0.110041 H\n0.989231 0.087612 0.987462 H\n0.652240 0.969517 0.400683 H\n0.516404 0.075470 0.710276 H\n0.380417 0.050279 0.341642 H\n0.016403 0.575470 0.789724 H\n0.865843 0.575440 0.389959 H\n0.330770 0.949310 0.449829 H\n0.830770 0.050690 0.550171 H\n0.652240 0.530483 0.900683 H\n0.516360 0.997026 0.820336 H\n0.991465 0.744435 0.065909 H\n",
"nsites": 64,
"nelements": 3,
"elements": [
"Al",
"B",
"H"
],
"chemical_system": "Al-B-H",
"density": 0.7794593330382318,
"density_atomic": 0.10502644618649001,
"volume": 609.3703283681381,
"volume_molar": 5.7339279568755455,
"formula_full": "Al4 B12 H48",
"formula_reduced": "Al(BH4)3",
"formula_anonymous": "AB3C12",
"energy_above_hull": 3.580274409375,
"spacegroup": 33
},
{
"id": "jvasp-88413",
"created_at": "2022-09-04T14:36:13.206257Z",
"updated_at": "2022-09-04T14:36:13.206278Z",
"structure_string": "Na1 Al6 Fe3 Si6 B3 O30 F1\n1.0\n8.658763 -0.001096 -3.824421\n-5.869706 6.365589 -3.824421\n-0.000481 -0.001096 9.465748\nNa Al Fe Si B O F\n1 6 3 6 3 30 1\ndirect\n0.237256 0.237256 0.237257 Na\n0.894931 0.558935 0.342442 Al\n0.894931 0.342442 0.558935 Al\n0.342442 0.894932 0.558936 Al\n0.558935 0.342442 0.894932 Al\n0.342442 0.558935 0.894932 Al\n0.558935 0.894932 0.342443 Al\n0.562885 0.562885 0.758918 Fe\n0.562885 0.758918 0.562885 Fe\n0.758917 0.562885 0.562885 Fe\n0.998028 0.191321 0.808710 Si\n0.191321 0.998028 0.808710 Si\n0.808709 0.191321 0.998028 Si\n0.998028 0.808710 0.191321 Si\n0.191321 0.808710 0.998029 Si\n0.808709 0.998028 0.191322 Si\n0.562215 0.562215 0.232342 B\n0.562215 0.232341 0.562215 B\n0.232341 0.562215 0.562215 B\n0.764987 0.964067 0.586704 O\n0.642449 0.164008 0.493712 O\n0.164008 0.493712 0.642450 O\n0.493712 0.642449 0.164008 O\n0.493712 0.164008 0.642449 O\n0.164008 0.642449 0.493713 O\n0.642449 0.493712 0.164008 O\n0.361342 0.786159 0.069260 O\n0.786159 0.069259 0.361343 O\n0.069259 0.361342 0.786159 O\n0.069259 0.786159 0.361343 O\n0.786159 0.361342 0.069259 O\n0.361342 0.069259 0.786159 O\n0.586703 0.764987 0.964068 O\n0.391391 0.775783 0.391392 O\n0.998336 0.998337 0.264837 O\n0.998336 0.264836 0.998337 O\n0.264836 0.998337 0.998337 O\n0.174990 0.884951 0.174990 O\n0.884950 0.174990 0.174990 O\n0.174990 0.174990 0.884951 O\n0.391391 0.391391 0.775783 O\n0.964067 0.586704 0.764987 O\n0.775782 0.391391 0.391392 O\n0.554412 0.374087 0.554413 O\n0.374087 0.554413 0.554413 O\n0.554412 0.554413 0.374087 O\n0.586703 0.964067 0.764988 O\n0.764987 0.586704 0.964068 O\n0.964067 0.764987 0.586704 O\n0.774298 0.774298 0.774299 F\n",
"nsites": 50,
"nelements": 7,
"elements": [
"Na",
"Al",
"Fe",
"Si",
"B",
"O",
"F"
],
"chemical_system": "Al-B-F-Fe-Na-O-Si",
"density": 3.350171969767801,
"density_atomic": 0.09585875017674672,
"volume": 521.6007918714647,
"volume_molar": 6.282306778354849,
"formula_full": "Na1 Al6 Fe3 Si6 B3 O30 F1",
"formula_reduced": "NaAl6Fe3Si6B3O30F",
"formula_anonymous": "ABC3D3E6F6G30",
"energy_above_hull": 3.18316373865,
"spacegroup": 160
},
{
"id": "jvasp-15269",
"created_at": "2022-09-04T14:35:56.839214Z",
"updated_at": "2022-09-04T14:35:56.839241Z",
"structure_string": "Al1 Fe2 B2\n1.0\n2.837777 0.000000 0.000000\n0.000000 2.817382 -0.746445\n0.000000 0.006878 5.716141\nAl Fe B\n1 2 2\ndirect\n0.000000 0.000000 0.000000 Al\n0.500001 0.645544 0.291089 Fe\n0.500001 0.354456 0.708912 Fe\n0.000000 0.793220 0.586440 B\n0.000000 0.206780 0.413560 B\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Al",
"Fe",
"B"
],
"chemical_system": "Al-B-Fe",
"density": 5.822369349554082,
"density_atomic": 0.10937161939926567,
"volume": 45.71569871108236,
"volume_molar": 5.506127451597772,
"formula_full": "Al1 Fe2 B2",
"formula_reduced": "Al(FeB)2",
"formula_anonymous": "AB2C2",
"energy_above_hull": 3.655031793333333,
"spacegroup": 65
},
{
"id": "jvasp-92499",
"created_at": "2022-09-04T14:36:11.205443Z",
"updated_at": "2022-09-04T14:36:11.205471Z",
"structure_string": "Al1 Fe2 B2\n1.0\n0.000000 0.000000 -2.837692\n-2.914675 0.000000 0.000000\n1.457337 5.527237 0.000000\nAl Fe B\n1 2 2\ndirect\n0.000000 0.000000 0.000000 Al\n0.500000 0.645544 0.291086 Fe\n0.500000 0.354457 0.708914 Fe\n0.000000 0.793222 0.586443 B\n0.000000 0.206779 0.413557 B\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Al",
"Fe",
"B"
],
"chemical_system": "Al-B-Fe",
"density": 5.822394596605418,
"density_atomic": 0.10937209365823548,
"volume": 45.71550047879614,
"volume_molar": 5.506103575943154,
"formula_full": "Al1 Fe2 B2",
"formula_reduced": "Al(FeB)2",
"formula_anonymous": "AB2C2",
"energy_above_hull": 3.655031793333333,
"spacegroup": 65
},
{
"id": "jvasp-108701",
"created_at": "2022-09-04T14:38:27.172408Z",
"updated_at": "2022-09-04T14:38:27.172429Z",
"structure_string": "Al1 Fe3 B1\n1.0\n3.808043 -0.000000 0.000000\n0.000000 3.808043 0.000000\n-0.000000 -0.000000 3.808043\nAl Fe B\n1 3 1\ndirect\n0.500000 0.500000 0.500000 Al\n0.500000 0.000000 -0.000000 Fe\n-0.000000 0.500000 -0.000000 Fe\n0.000000 0.000000 0.500000 Fe\n0.000000 0.000000 0.000000 B\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Al",
"Fe",
"B"
],
"chemical_system": "Al-B-Fe",
"density": 6.17434321728904,
"density_atomic": 0.09054500000691926,
"volume": 55.22116074457906,
"volume_molar": 6.65099205868883,
"formula_full": "Al1 Fe3 B1",
"formula_reduced": "AlFe3B",
"formula_anonymous": "ABC3",
"energy_above_hull": 3.474802376666666,
"spacegroup": 221
},
{
"id": "jvasp-121994",
"created_at": "2022-09-04T14:38:53.390619Z",
"updated_at": "2022-09-04T14:38:53.390645Z",
"structure_string": "Er1 Al3 B4 O12\n1.0\n5.713598 -0.010657 -1.465674\n-1.886606 5.393147 -1.465674\n-0.007577 -0.010657 5.898588\nEr Al B O\n1 3 4 12\ndirect\n0.000000 0.000000 0.000000 Er\n-0.000001 0.444698 0.555302 Al\n0.444698 0.555302 0.000001 Al\n0.555301 -0.000001 0.444699 Al\n0.500000 0.500000 0.500001 B\n0.500000 0.056254 0.943746 B\n0.056254 0.943746 0.500001 B\n0.943745 0.500000 0.056256 B\n0.369744 0.219256 0.971045 O\n0.780743 0.630255 0.028956 O\n0.028955 0.780743 0.630256 O\n0.630255 0.028955 0.780744 O\n0.091956 0.500000 0.908043 O\n0.648768 0.351231 0.500001 O\n0.500000 0.908043 0.091958 O\n0.351231 0.500000 0.648769 O\n0.971044 0.369744 0.219258 O\n0.500000 0.648768 0.351233 O\n0.908043 0.091956 0.500001 O\n0.219256 0.971045 0.369746 O\n",
"nsites": 20,
"nelements": 4,
"elements": [
"Er",
"Al",
"B",
"O"
],
"chemical_system": "Al-B-Er-O",
"density": 4.423876944449614,
"density_atomic": 0.11021507016336186,
"volume": 181.46338763252433,
"volume_molar": 5.463990315547523,
"formula_full": "Er1 Al3 B4 O12",
"formula_reduced": "ErAl3(BO3)4",
"formula_anonymous": "AB3C4D12",
"energy_above_hull": 3.2132520366666664,
"spacegroup": 155
},
{
"id": "jvasp-41841",
"created_at": "2022-09-04T14:37:33.953835Z",
"updated_at": "2022-09-04T14:37:33.953859Z",
"structure_string": "Be1 Al1 Rh2\n1.0\n0.000000 2.904018 2.904018\n2.904018 0.000000 2.904018\n2.904018 2.904018 0.000000\nBe Al Rh\n1 1 2\ndirect\n0.750000 0.750000 0.750000 Be\n0.250000 0.250000 0.250000 Al\n0.000000 0.000000 0.000000 Rh\n0.500000 0.500000 0.500000 Rh\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Be",
"Al",
"Rh"
],
"chemical_system": "Al-Be-Rh",
"density": 8.197585690030946,
"density_atomic": 0.08166426993169013,
"volume": 48.9810293209734,
"volume_molar": 7.374266328514726,
"formula_full": "Be1 Al1 Rh2",
"formula_reduced": "BeAlRh2",
"formula_anonymous": "ABC2",
"energy_above_hull": 2.1104962250000003,
"spacegroup": 225
},
{
"id": "jvasp-21116",
"created_at": "2022-09-04T14:38:34.730883Z",
"updated_at": "2022-09-04T14:38:34.730898Z",
"structure_string": "Be6 Al4 Si12 O36\n1.0\n4.651785 -8.057128 -0.000000\n4.651785 8.057128 0.000000\n0.000000 -0.000000 9.279567\nBe Al Si O\n6 4 12 36\ndirect\n0.500000 0.000000 0.750000 Be\n0.500001 0.500001 0.250000 Be\n0.000000 0.500000 0.250000 Be\n0.500000 0.000000 0.250000 Be\n0.500001 0.500001 0.750000 Be\n0.000000 0.500000 0.750000 Be\n0.333333 0.666668 0.750000 Al\n0.666668 0.333333 0.750000 Al\n0.666668 0.333333 0.250000 Al\n0.333333 0.666668 0.250000 Al\n0.115796 0.727826 0.500000 Si\n0.612031 0.884206 0.500000 Si\n0.727826 0.612031 0.500000 Si\n0.272175 0.884205 0.000000 Si\n0.884206 0.612031 0.000000 Si\n0.272175 0.387970 0.500000 Si\n0.612031 0.727826 0.000000 Si\n0.115796 0.387970 0.000000 Si\n0.387970 0.115796 0.500000 Si\n0.884205 0.272175 0.500000 Si\n0.727826 0.115796 0.000000 Si\n0.387970 0.272175 0.000000 Si\n0.500785 0.646013 0.854389 O\n0.145228 0.499216 0.854389 O\n0.499216 0.145228 0.645612 O\n0.854773 0.353988 0.645612 O\n0.646013 0.145228 0.854389 O\n0.646013 0.500785 0.645612 O\n0.353988 0.499216 0.645612 O\n0.646013 0.145228 0.145612 O\n0.145228 0.646013 0.645612 O\n0.145228 0.499216 0.145612 O\n0.500785 0.646013 0.145612 O\n0.499216 0.353988 0.145612 O\n0.854773 0.500785 0.145612 O\n0.500785 0.854773 0.354389 O\n0.499216 0.353988 0.854389 O\n0.500785 0.854773 0.645612 O\n0.854773 0.500785 0.854389 O\n0.310604 0.236827 0.500000 O\n0.353988 0.499216 0.354389 O\n0.236828 0.926225 0.500000 O\n0.926225 0.689397 0.500000 O\n0.073776 0.310604 0.500000 O\n0.689397 0.763174 0.500000 O\n0.926225 0.236828 0.000000 O\n0.763173 0.073776 0.500000 O\n0.145228 0.646013 0.354389 O\n0.236827 0.310604 0.000000 O\n0.689397 0.926225 0.000000 O\n0.310604 0.073776 0.000000 O\n0.763174 0.689397 0.000000 O\n0.073776 0.763173 0.000000 O\n0.854773 0.353988 0.354389 O\n0.499216 0.145228 0.354389 O\n0.646013 0.500785 0.354389 O\n0.353988 0.854773 0.854389 O\n0.353988 0.854773 0.145612 O\n",
"nsites": 58,
"nelements": 4,
"elements": [
"Be",
"Al",
"Si",
"O"
],
"chemical_system": "Al-Be-O-Si",
"density": 2.5662645830223463,
"density_atomic": 0.0833816315880016,
"volume": 695.5968466362566,
"volume_molar": 7.222382970095983,
"formula_full": "Be6 Al4 Si12 O36",
"formula_reduced": "Be3Al2(SiO3)6",
"formula_anonymous": "A2B3C6D18",
"energy_above_hull": 3.045590637931034,
"spacegroup": 192
},
{
"id": "jvasp-20842",
"created_at": "2022-09-04T14:38:36.513082Z",
"updated_at": "2022-09-04T14:38:36.513102Z",
"structure_string": "Be4 Al8 O16\n1.0\n4.461366 -0.000000 0.000000\n-0.000000 5.523769 0.000000\n0.000000 0.000000 9.484499\nBe Al O\n4 8 16\ndirect\n0.066654 0.250000 0.407322 Be\n0.933347 0.750000 0.592678 Be\n0.433346 0.250000 0.907322 Be\n0.566654 0.750000 0.092678 Be\n0.000000 0.000000 0.000000 Al\n0.500000 0.000000 0.500000 Al\n0.500000 0.500000 0.500000 Al\n0.000000 0.500000 0.000000 Al\n0.505642 0.250000 0.227040 Al\n0.994359 0.250000 0.727040 Al\n0.494358 0.750000 0.772960 Al\n0.005642 0.750000 0.272960 Al\n0.212874 0.750000 0.090382 O\n0.259360 0.250000 0.066461 O\n0.759360 0.750000 0.433539 O\n0.287127 0.750000 0.590382 O\n0.787127 0.250000 0.909618 O\n0.712874 0.250000 0.409618 O\n0.743006 0.515849 0.163200 O\n0.256995 0.484151 0.836800 O\n0.243005 0.484151 0.336800 O\n0.256995 0.015849 0.836800 O\n0.743006 0.984151 0.163200 O\n0.243005 0.015849 0.336800 O\n0.240640 0.250000 0.566461 O\n0.756995 0.515849 0.663200 O\n0.756995 0.984151 0.663200 O\n0.740641 0.750000 0.933539 O\n",
"nsites": 28,
"nelements": 3,
"elements": [
"Be",
"Al",
"O"
],
"chemical_system": "Al-Be-O",
"density": 3.608296618500159,
"density_atomic": 0.11979543659488218,
"volume": 233.73177473102675,
"volume_molar": 5.027020169695908,
"formula_full": "Be4 Al8 O16",
"formula_reduced": "BeAl2O4",
"formula_anonymous": "AB2C4",
"energy_above_hull": 1.9570608142857135,
"spacegroup": 62
},
{
"id": "jvasp-102798",
"created_at": "2022-09-04T14:37:00.531628Z",
"updated_at": "2022-09-04T14:37:00.531645Z",
"structure_string": "Be4 Al1 Ni1\n1.0\n3.678897 -0.000000 2.124012\n1.226299 3.468498 2.124012\n-0.000000 -0.000000 4.248025\nBe Al Ni\n4 1 1\ndirect\n0.626068 0.626067 0.121798 Be\n0.626068 0.121799 0.626066 Be\n0.121799 0.626067 0.626066 Be\n0.626068 0.626067 0.626065 Be\n0.250000 0.250000 0.249999 Al\n0.000000 0.000000 0.000000 Ni\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Be",
"Al",
"Ni"
],
"chemical_system": "Al-Be-Ni",
"density": 3.7288763481034954,
"density_atomic": 0.11068916446528201,
"volume": 54.205847780899255,
"volume_molar": 5.440587422528483,
"formula_full": "Be4 Al1 Ni1",
"formula_reduced": "Be4AlNi",
"formula_anonymous": "ABC4",
"energy_above_hull": 1.8063616,
"spacegroup": 216
},
{
"id": "jvasp-25841",
"created_at": "2022-09-04T14:38:29.752310Z",
"updated_at": "2022-09-04T14:38:29.752336Z",
"structure_string": "Na6 Be2 Al2 Si4 O16\n1.0\n6.886050 0.000000 0.000000\n0.000000 7.230920 0.000000\n0.000000 0.000000 7.333615\nNa Be Al Si O\n6 2 2 4 16\ndirect\n0.249708 0.285716 0.321835 Na\n0.750292 0.714284 0.321835 Na\n0.500000 0.000000 0.033211 Na\n0.000000 0.500000 0.966788 Na\n0.749708 0.214284 0.678165 Na\n0.250292 0.785716 0.678165 Na\n0.000000 0.500000 0.568603 Be\n0.500000 0.000000 0.431397 Be\n0.000000 0.000000 0.037125 Al\n0.500000 0.500000 0.962875 Al\n0.736880 0.803505 0.739383 Si\n0.236880 0.696495 0.260616 Si\n0.763120 0.303505 0.260616 Si\n0.263120 0.196495 0.739383 Si\n0.079845 0.335046 0.707732 O\n0.579845 0.164954 0.292267 O\n0.295911 0.538874 0.103500 O\n0.823714 0.416640 0.443735 O\n0.543349 0.697820 0.826811 O\n0.676286 0.916640 0.556264 O\n0.323714 0.083360 0.556264 O\n0.043349 0.802179 0.173188 O\n0.456651 0.302179 0.826811 O\n0.420155 0.835046 0.292267 O\n0.204089 0.038874 0.896500 O\n0.795911 0.961126 0.896500 O\n0.176286 0.583360 0.443735 O\n0.704089 0.461126 0.103500 O\n0.956651 0.197820 0.173188 O\n0.920155 0.664954 0.707732 O\n",
"nsites": 30,
"nelements": 5,
"elements": [
"Na",
"Be",
"Al",
"Si",
"O"
],
"chemical_system": "Al-Be-Na-O-Si",
"density": 2.6295973610959384,
"density_atomic": 0.08215602522214241,
"volume": 365.1588537649276,
"volume_molar": 7.330126723775499,
"formula_full": "Na6 Be2 Al2 Si4 O16",
"formula_reduced": "Na3BeAl(SiO4)2",
"formula_anonymous": "ABC2D3E8",
"energy_above_hull": 2.0458454066666665,
"spacegroup": 18
}
]
}