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=219",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=chemical_system&page=217",
"results": [
{
"id": "jvasp-103898",
"created_at": "2022-09-04T14:37:02.015206Z",
"updated_at": "2022-09-04T14:37:02.015223Z",
"structure_string": "Al1 H16 C10 Cl1 O4\n1.0\n4.757365 -0.013961 0.833531\n0.641731 6.436852 2.552180\n0.043223 -0.203279 9.248469\nAl H C Cl O\n1 16 10 1 4\ndirect\n0.143802 0.746251 0.902399 Al\n0.349397 0.276375 0.390406 H\n0.502815 0.512411 0.495959 H\n0.532435 0.319064 0.676522 H\n-0.008337 0.299158 0.707497 H\n0.982992 0.524957 0.542660 H\n0.824079 0.201320 0.174403 H\n0.926281 0.951417 0.163428 H\n0.301984 0.084134 0.574583 H\n0.638808 0.836929 0.456684 H\n0.872384 0.243181 0.411572 H\n0.812642 0.048030 0.593593 H\n0.241290 0.169215 0.980086 H\n0.572670 0.272219 0.955398 H\n0.421579 0.875493 0.220928 H\n0.315029 0.123813 0.234569 H\n0.001376 0.875271 0.414049 H\n0.462594 0.131299 0.000795 C\n0.478863 0.035143 0.178758 C\n0.739033 0.117604 0.478715 C\n0.788168 0.954553 0.397500 C\n0.768229 0.040960 0.221530 C\n0.407880 0.374745 0.578615 C\n0.432626 0.208810 0.502205 C\n0.090804 0.562942 0.742392 C\n0.601587 0.983329 0.918768 C\n0.102316 0.435801 0.639897 C\n0.175300 0.561151 0.141909 Cl\n0.274941 0.695094 0.714141 O\n0.875399 0.959750 0.897593 O\n0.460534 0.882262 0.872217 O\n0.916846 0.545714 0.866384 O\n",
"nsites": 32,
"nelements": 5,
"elements": [
"Al",
"H",
"C",
"Cl",
"O"
],
"chemical_system": "Al-C-Cl-H-O",
"density": 1.5281619973872167,
"density_atomic": 0.11211561935630324,
"volume": 285.41964254154504,
"volume_molar": 5.371366447043965,
"formula_full": "Al1 H16 C10 Cl1 O4",
"formula_reduced": "AlH16C10ClO4",
"formula_anonymous": "ABC4D10E16",
"energy_above_hull": 4.533354089609375,
"spacegroup": 1
},
{
"id": "jvasp-103900",
"created_at": "2022-09-04T14:37:01.870945Z",
"updated_at": "2022-09-04T14:37:01.870981Z",
"structure_string": "Al1 H16 C10 Cl1 O4\n1.0\n5.032582 -0.030513 0.212828\n0.800615 6.453481 1.987840\n0.146263 -0.043028 9.148401\nAl H C Cl O\n1 16 10 1 4\ndirect\n0.002348 0.682355 0.914988 Al\n0.771364 0.365385 0.380037 H\n0.486947 0.597098 0.490371 H\n0.649524 0.410852 0.644520 H\n0.226415 0.222171 0.697692 H\n0.075821 0.416045 0.544958 H\n0.731122 0.809320 0.248900 H\n0.448187 0.946493 0.310883 H\n0.440462 0.317646 0.366156 H\n0.866636 0.787577 0.490466 H\n0.810886 0.056488 0.621977 H\n0.497728 0.995354 0.580378 H\n0.361676 0.090729 0.017187 H\n0.579631 0.273539 0.908113 H\n0.612686 0.283573 0.163360 H\n0.914072 0.151747 0.117517 H\n0.013567 0.008431 0.383307 H\n0.569787 0.125321 0.996165 C\n0.699679 0.138678 0.141957 C\n0.675879 0.070418 0.527794 C\n0.819145 0.949415 0.421966 C\n0.663395 0.952086 0.280916 C\n0.502584 0.432647 0.555427 C\n0.598324 0.300635 0.448229 C\n0.135634 0.510006 0.738713 C\n0.728697 0.961171 0.940695 C\n0.230746 0.385546 0.631800 C\n0.145444 0.530825 0.139300 Cl\n0.251673 0.663395 0.752094 O\n0.980462 0.968756 0.901166 O\n0.639517 0.791201 0.940744 O\n0.929669 0.469955 0.828617 O\n",
"nsites": 32,
"nelements": 5,
"elements": [
"Al",
"H",
"C",
"Cl",
"O"
],
"chemical_system": "Al-C-Cl-H-O",
"density": 1.4658350509312699,
"density_atomic": 0.10754292077039213,
"volume": 297.55561566270933,
"volume_molar": 5.599755629529051,
"formula_full": "Al1 H16 C10 Cl1 O4",
"formula_reduced": "AlH16C10ClO4",
"formula_anonymous": "ABC4D10E16",
"energy_above_hull": 4.533833152109374,
"spacegroup": 1
},
{
"id": "jvasp-103901",
"created_at": "2022-09-04T14:37:00.346578Z",
"updated_at": "2022-09-04T14:37:00.346603Z",
"structure_string": "Al1 H6 C5 Cl1 O4\n1.0\n5.118396 0.046620 1.105424\n-0.075029 5.295854 2.726600\n-0.085888 -0.227230 6.285874\nAl H C Cl O\n1 6 5 1 4\ndirect\n0.238677 0.900178 0.529172 Al\n0.750984 0.557572 0.502027 H\n0.803664 0.283918 0.456094 H\n0.119549 0.551619 0.060661 H\n0.970441 0.812529 0.103490 H\n0.525580 0.612411 0.153305 H\n0.703126 0.399435 0.055950 H\n0.891279 0.460197 0.416338 C\n0.941804 0.617482 0.142988 C\n0.140379 0.408731 0.515021 C\n0.692299 0.760790 0.792124 C\n0.708681 0.589109 0.045147 C\n0.351882 0.071631 0.141215 Cl\n0.257742 0.200241 0.558727 O\n0.472537 0.778966 0.730055 O\n0.889809 0.878159 0.643055 O\n0.244466 0.574453 0.547504 O\n",
"nsites": 17,
"nelements": 5,
"elements": [
"Al",
"H",
"C",
"Cl",
"O"
],
"chemical_system": "Al-C-Cl-H-O",
"density": 1.836452565961429,
"density_atomic": 0.09765033395986718,
"volume": 174.09054644899365,
"volume_molar": 6.167045739418575,
"formula_full": "Al1 H6 C5 Cl1 O4",
"formula_reduced": "AlH6C5ClO4",
"formula_anonymous": "ABC4D5E6",
"energy_above_hull": 4.151648874558823,
"spacegroup": 1
},
{
"id": "jvasp-112064",
"created_at": "2022-09-04T14:38:43.588422Z",
"updated_at": "2022-09-04T14:38:43.588433Z",
"structure_string": "Al1 H16 C10 Cl1 O4\n1.0\n4.496240 -0.200018 -1.138609\n-2.550008 6.994079 -1.400807\n-0.263689 0.476400 9.790473\nAl H C Cl O\n1 16 10 1 4\ndirect\n0.196207 0.312812 0.902877 Al\n0.406441 0.728737 0.533225 H\n0.794590 0.499479 0.443904 H\n0.448214 0.403007 0.494956 H\n0.721191 0.653748 0.732193 H\n0.084099 0.729585 0.687969 H\n0.573598 0.192320 0.263573 H\n0.795984 0.054451 0.226325 H\n0.351664 0.626502 0.351268 H\n0.922437 0.178277 0.491910 H\n-0.005698 0.921982 0.570000 H\n0.917271 0.835181 0.383158 H\n0.395950 0.830372 0.976419 H\n0.980363 0.737384 0.960546 H\n0.296935 0.752510 0.199095 H\n0.085117 -0.093308 0.206633 H\n0.521674 0.050854 0.479556 H\n0.209304 0.861777 0.012128 C\n0.288080 0.889050 0.177600 C\n0.804627 0.873129 0.462056 C\n0.710434 0.046368 0.432107 C\n0.602381 0.054493 0.270907 C\n0.655168 0.534957 0.510365 C\n0.533247 0.690455 0.460734 C\n0.971038 0.467052 0.745686 C\n0.162403 0.027458 0.956904 C\n0.863575 0.606928 0.673360 C\n0.572502 0.520795 0.088307 Cl\n0.835723 0.381496 0.831184 O\n0.021363 0.127368 0.007777 O\n0.274492 0.088297 0.855991 O\n0.224366 0.433918 0.740947 O\n",
"nsites": 32,
"nelements": 5,
"elements": [
"Al",
"H",
"C",
"Cl",
"O"
],
"chemical_system": "Al-C-Cl-H-O",
"density": 1.4295981573697616,
"density_atomic": 0.10488435330690123,
"volume": 305.0979387398716,
"volume_molar": 5.7416960396167624,
"formula_full": "Al1 H16 C10 Cl1 O4",
"formula_reduced": "AlH16C10ClO4",
"formula_anonymous": "ABC4D10E16",
"energy_above_hull": 4.534092527109375,
"spacegroup": 1
},
{
"id": "jvasp-15854",
"created_at": "2022-09-04T14:37:53.853293Z",
"updated_at": "2022-09-04T14:37:53.853313Z",
"structure_string": "Al1 Co3 C1\n1.0\n3.727241 0.000000 -0.000000\n-0.000000 3.727241 0.000000\n0.000000 -0.000000 3.727241\nAl Co C\n1 3 1\ndirect\n0.000000 0.000000 0.000000 Al\n0.000000 0.500000 0.500000 Co\n0.500000 0.000000 0.500000 Co\n0.500000 0.500000 0.000000 Co\n0.500000 0.500000 0.500000 C\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Al",
"Co",
"C"
],
"chemical_system": "Al-C-Co",
"density": 6.920247998108788,
"density_atomic": 0.09656229522016335,
"volume": 51.78004508488465,
"volume_molar": 6.2365344012064305,
"formula_full": "Al1 Co3 C1",
"formula_reduced": "AlCo3C",
"formula_anonymous": "ABC3",
"energy_above_hull": 3.6959031000000007,
"spacegroup": 221
},
{
"id": "jvasp-27011",
"created_at": "2022-09-04T14:38:35.416984Z",
"updated_at": "2022-09-04T14:38:35.417010Z",
"structure_string": "Ta12 Al8 Co4 C4\n1.0\n7.109739 0.000000 4.104810\n2.369913 6.703126 4.104810\n0.000000 0.000000 8.209619\nTa Al Co C\n12 8 4 4\ndirect\n0.313787 0.936213 0.936213 Ta\n0.063788 0.063788 0.686213 Ta\n0.686212 0.686213 0.063788 Ta\n0.063787 0.686213 0.686213 Ta\n0.063787 0.686213 0.063788 Ta\n0.686212 0.063788 0.686212 Ta\n0.936212 0.313788 0.936213 Ta\n0.936212 0.936213 0.313788 Ta\n0.313787 0.313788 0.936213 Ta\n0.313787 0.936213 0.313788 Ta\n0.686212 0.063788 0.063788 Ta\n0.936212 0.313788 0.313788 Ta\n0.706933 0.706934 0.706934 Al\n0.293066 0.293067 0.620801 Al\n0.293066 0.620802 0.293067 Al\n0.620801 0.293067 0.293067 Al\n0.706933 0.706934 0.379199 Al\n0.379198 0.706934 0.706934 Al\n0.293066 0.293067 0.293067 Al\n0.706933 0.379199 0.706933 Al\n0.500000 0.500000 0.500000 Co\n0.500000 0.500000 0.000000 Co\n-0.000000 0.500000 0.500000 Co\n0.500000 -0.000000 0.500000 Co\n0.500000 -0.000000 -0.000000 C\n0.000000 0.000000 0.000000 C\n-0.000000 -0.000000 0.500000 C\n-0.000000 0.500000 0.000000 C\n",
"nsites": 28,
"nelements": 4,
"elements": [
"Ta",
"Al",
"Co",
"C"
],
"chemical_system": "Al-C-Co-Ta",
"density": 11.336248051392719,
"density_atomic": 0.07156554582271987,
"volume": 391.24972328668883,
"volume_molar": 8.414860378369609,
"formula_full": "Ta12 Al8 Co4 C4",
"formula_reduced": "Ta3Al2CoC",
"formula_anonymous": "ABC2D3",
"energy_above_hull": 5.271764871428571,
"spacegroup": 227
},
{
"id": "jvasp-16216",
"created_at": "2022-09-04T14:36:54.778740Z",
"updated_at": "2022-09-04T14:36:54.778752Z",
"structure_string": "Al2 Cr4 C2\n1.0\n1.424353 -2.467053 0.000000\n1.424353 2.467053 -0.000000\n0.000000 -0.000000 12.680747\nAl Cr C\n2 4 2\ndirect\n0.666666 0.333332 0.250000 Al\n0.333332 0.666666 0.750000 Al\n0.333332 0.666666 0.415212 Cr\n0.666666 0.333332 0.915213 Cr\n0.666666 0.333332 0.584788 Cr\n0.333332 0.666666 0.084788 Cr\n0.000000 0.000000 0.500000 C\n0.000000 0.000000 0.000000 C\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Al",
"Cr",
"C"
],
"chemical_system": "Al-C-Cr",
"density": 5.328401231174088,
"density_atomic": 0.08976748117533043,
"volume": 89.11913195352675,
"volume_molar": 6.708599462914398,
"formula_full": "Al2 Cr4 C2",
"formula_reduced": "AlCr2C",
"formula_anonymous": "ABC2",
"energy_above_hull": 4.267896899999999,
"spacegroup": 194
},
{
"id": "jvasp-108809",
"created_at": "2022-09-04T14:38:19.721215Z",
"updated_at": "2022-09-04T14:38:19.721233Z",
"structure_string": "Al1 Cr4 Ga1 C2\n1.0\n2.857927 0.000000 0.000000\n-1.428963 2.475038 0.000000\n0.000000 0.000000 12.547321\nAl Cr Ga C\n1 4 1 2\ndirect\n0.666668 0.333334 -0.000000 Al\n0.666668 0.333334 0.663668 Cr\n0.333335 0.666667 0.833784 Cr\n0.333335 0.666667 0.166216 Cr\n0.666668 0.333334 0.336332 Cr\n0.333335 0.666667 0.500000 Ga\n0.000000 0.000000 0.748766 C\n0.000000 0.000000 0.251234 C\n",
"nsites": 8,
"nelements": 4,
"elements": [
"Al",
"Cr",
"Ga",
"C"
],
"chemical_system": "Al-C-Cr-Ga",
"density": 6.150047213633478,
"density_atomic": 0.09013759694127395,
"volume": 88.75319812677195,
"volume_molar": 6.681053150244863,
"formula_full": "Al1 Cr4 Ga1 C2",
"formula_reduced": "AlCr4GaC2",
"formula_anonymous": "ABC2D4",
"energy_above_hull": 4.704211840625,
"spacegroup": 187
},
{
"id": "jvasp-108063",
"created_at": "2022-09-04T14:35:51.429392Z",
"updated_at": "2022-09-04T14:35:51.429420Z",
"structure_string": "Ti1 Al2 Cr3 C2\n1.0\n2.898999 0.000000 0.000000\n-1.449499 2.510607 0.000000\n0.000000 0.000000 12.871456\nTi Al Cr C\n1 2 3 2\ndirect\n0.666667 0.333334 0.584230 Ti\n0.666667 0.333334 0.245744 Al\n0.333334 0.666667 0.763031 Al\n0.333334 0.666667 0.407979 Cr\n0.333334 0.666667 0.085281 Cr\n0.666667 0.333334 0.922118 Cr\n0.000000 0.000000 0.488045 C\n0.000000 0.000000 0.003574 C\n",
"nsites": 8,
"nelements": 4,
"elements": [
"Ti",
"Al",
"Cr",
"C"
],
"chemical_system": "Al-C-Cr-Ti",
"density": 4.995706402331811,
"density_atomic": 0.0853956030188688,
"volume": 93.68163836529546,
"volume_molar": 7.052050160790319,
"formula_full": "Ti1 Al2 Cr3 C2",
"formula_reduced": "TiAl2Cr3C2",
"formula_anonymous": "AB2C2D3",
"energy_above_hull": 4.854659516666667,
"spacegroup": 156
},
{
"id": "jvasp-111108",
"created_at": "2022-09-04T14:38:37.211815Z",
"updated_at": "2022-09-04T14:38:37.211837Z",
"structure_string": "Al2 V2 Cr2 C2\n1.0\n2.881018 -0.000000 0.000000\n-1.440509 2.495035 0.000000\n-0.000000 0.000000 12.840741\nAl V Cr C\n2 2 2 2\ndirect\n0.333334 0.666668 0.742606 Al\n0.666667 0.333334 0.257394 Al\n0.666667 0.333334 0.911475 V\n0.333334 0.666668 0.088525 V\n0.333334 0.666668 0.417484 Cr\n0.666667 0.333334 0.582515 Cr\n0.000000 0.000000 0.500000 C\n0.000000 0.000000 0.000000 C\n",
"nsites": 8,
"nelements": 4,
"elements": [
"Al",
"V",
"Cr",
"C"
],
"chemical_system": "Al-C-Cr-V",
"density": 5.106697136511358,
"density_atomic": 0.08667169437727525,
"volume": 92.30233766028172,
"volume_molar": 6.94822087334082,
"formula_full": "Al2 V2 Cr2 C2",
"formula_reduced": "AlVCrC",
"formula_anonymous": "ABCD",
"energy_above_hull": 4.1167336,
"spacegroup": 164
},
{
"id": "jvasp-110745",
"created_at": "2022-09-04T14:38:38.080446Z",
"updated_at": "2022-09-04T14:38:38.080466Z",
"structure_string": "Al1 Cd3\n1.0\n4.019231 -0.037876 -3.629079\n-0.818675 3.935152 -3.629079\n0.031105 0.037876 5.415114\nAl Cd\n1 3\ndirect\n0.000000 0.000000 0.000000 Al\n0.749999 0.250000 0.499999 Cd\n0.250000 0.750000 0.499999 Cd\n0.500000 0.499999 -0.000001 Cd\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Al",
"Cd"
],
"chemical_system": "Al-Cd",
"density": 6.984347376310392,
"density_atomic": 0.04619334878073772,
"volume": 86.59255294493761,
"volume_molar": 13.03681356505417,
"formula_full": "Al1 Cd3",
"formula_reduced": "AlCd3",
"formula_anonymous": "AB3",
"energy_above_hull": 0.0,
"spacegroup": 139
},
{
"id": "jvasp-107891",
"created_at": "2022-09-04T14:36:00.861870Z",
"updated_at": "2022-09-04T14:36:00.861891Z",
"structure_string": "Al3 Cd1\n1.0\n4.223820 0.000000 0.000000\n0.000000 4.223820 0.000000\n0.000000 0.000000 4.223820\nAl Cd\n3 1\ndirect\n-0.000000 0.500000 0.500000 Al\n0.500000 0.000000 0.500000 Al\n0.500000 0.500000 -0.000000 Al\n0.000000 0.000000 0.000000 Cd\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Al",
"Cd"
],
"chemical_system": "Al-Cd",
"density": 4.260785595454802,
"density_atomic": 0.0530815730522505,
"volume": 75.35571705952697,
"volume_molar": 11.345068380080116,
"formula_full": "Al3 Cd1",
"formula_reduced": "Al3Cd",
"formula_anonymous": "AB3",
"energy_above_hull": 1.1483052000000002,
"spacegroup": 221
}
]
}