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=formula_anonymous&page=361",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=formula_anonymous&page=359",
"results": [
{
"id": "jvasp-101697",
"created_at": "2022-09-04T14:36:35.267668Z",
"updated_at": "2022-09-04T14:36:35.267687Z",
"structure_string": "Rb5 Bi4\n1.0\n6.683177 -0.037002 2.447275\n4.184496 5.211163 2.447275\n0.008929 0.004251 11.967078\nRb Bi\n5 4\ndirect\n0.406189 0.406188 0.888523 Rb\n0.601921 0.601920 0.106560 Rb\n0.751542 0.751541 0.664488 Rb\n0.256851 0.256850 0.330681 Rb\n0.504703 0.504702 0.497223 Rb\n0.051363 0.051362 0.671021 Bi\n0.956757 0.956756 0.324194 Bi\n0.113920 0.113920 0.889044 Bi\n0.894160 0.894159 0.106164 Bi\n",
"nsites": 9,
"nelements": 2,
"elements": [
"Rb",
"Bi"
],
"chemical_system": "Bi-Rb",
"density": 5.01251585089887,
"density_atomic": 0.021505830565481297,
"volume": 418.4911609247853,
"volume_molar": 28.002363087831874,
"formula_full": "Rb5 Bi4",
"formula_reduced": "Rb5Bi4",
"formula_anonymous": "A4B5",
"energy_above_hull": 0.2407681518518519,
"spacegroup": 12
},
{
"id": "jvasp-16651",
"created_at": "2022-09-04T14:37:57.428553Z",
"updated_at": "2022-09-04T14:37:57.428569Z",
"structure_string": "Ti5 Se4\n1.0\n3.389435 0.000000 0.869274\n1.694717 6.859177 0.434637\n-0.009279 -0.000000 7.078785\nTi Se\n5 4\ndirect\n0.000000 0.000000 0.000000 Ti\n0.306772 0.065217 0.321238 Ti\n0.628010 0.678762 0.065217 Ti\n0.371989 0.321238 0.934783 Ti\n0.693227 0.934783 0.678762 Ti\n0.057392 0.215543 0.669673 Se\n0.727063 0.330328 0.215543 Se\n0.272936 0.669673 0.784458 Se\n0.942607 0.784457 0.330328 Se\n",
"nsites": 9,
"nelements": 2,
"elements": [
"Ti",
"Se"
],
"chemical_system": "Se-Ti",
"density": 5.599831775019798,
"density_atomic": 0.05466866785037049,
"volume": 164.62811979675863,
"volume_molar": 11.01570789411359,
"formula_full": "Ti5 Se4",
"formula_reduced": "Ti5Se4",
"formula_anonymous": "A4B5",
"energy_above_hull": 3.1283383481481484,
"spacegroup": 87
},
{
"id": "jvasp-108769",
"created_at": "2022-09-04T14:37:56.679455Z",
"updated_at": "2022-09-04T14:37:56.679476Z",
"structure_string": "K5 As4\n1.0\n5.928222 -0.038639 2.245253\n3.693002 4.637569 2.245253\n-0.016019 -0.007657 10.421326\nK As\n5 4\ndirect\n0.396194 0.396194 0.896022 K\n0.609076 0.609076 0.099994 K\n0.749744 0.749744 0.666140 K\n0.255519 0.255519 0.329868 K\n0.502642 0.502642 0.497987 K\n0.102053 0.102052 0.889995 As\n0.903194 0.903194 0.106014 As\n0.047658 0.047657 0.683497 As\n0.957619 0.957620 0.312485 As\n",
"nsites": 9,
"nelements": 2,
"elements": [
"K",
"As"
],
"chemical_system": "As-K",
"density": 2.853072349880661,
"density_atomic": 0.031228055544976086,
"volume": 288.20238221485755,
"volume_molar": 19.28439236739103,
"formula_full": "K5 As4",
"formula_reduced": "K5As4",
"formula_anonymous": "A4B5",
"energy_above_hull": 0.7155837870370372,
"spacegroup": 12
},
{
"id": "jvasp-19955",
"created_at": "2022-09-04T14:37:35.830741Z",
"updated_at": "2022-09-04T14:37:35.830762Z",
"structure_string": "Mo5 As4\n1.0\n3.216954 0.000000 0.778166\n1.608477 6.846620 0.389083\n-0.001262 -0.000000 7.043777\nMo As\n5 4\ndirect\n0.700608 0.919991 0.678796 Mo\n0.379403 0.321204 0.919991 Mo\n0.620598 0.678796 0.080009 Mo\n0.299393 0.080009 0.321204 Mo\n0.000000 0.000000 0.000000 Mo\n0.942806 0.771043 0.343347 As\n0.286152 0.656653 0.771043 As\n0.713848 0.343347 0.228957 As\n0.057195 0.228957 0.656653 As\n",
"nsites": 9,
"nelements": 2,
"elements": [
"Mo",
"As"
],
"chemical_system": "As-Mo",
"density": 8.341735704562241,
"density_atomic": 0.05800921847193715,
"volume": 155.14775473753173,
"volume_molar": 10.381351306970808,
"formula_full": "Mo5 As4",
"formula_reduced": "Mo5As4",
"formula_anonymous": "A4B5",
"energy_above_hull": 5.129262944444445,
"spacegroup": 87
},
{
"id": "jvasp-13119",
"created_at": "2022-09-04T14:37:07.727898Z",
"updated_at": "2022-09-04T14:37:07.727935Z",
"structure_string": "Ti10 Ga8\n1.0\n3.930338 -6.807546 0.000000\n3.930338 6.807546 0.000000\n-0.000000 0.000000 5.389113\nTi Ga\n10 8\ndirect\n0.333333 0.666667 0.000000 Ti\n0.714428 -0.000000 0.750000 Ti\n-0.000000 0.285573 0.250000 Ti\n-0.000000 0.714428 0.750000 Ti\n0.285573 0.285573 0.750000 Ti\n0.714427 0.714427 0.250000 Ti\n0.333333 0.666667 0.500000 Ti\n0.666667 0.333333 0.000000 Ti\n0.666667 0.333333 0.500000 Ti\n0.285573 -0.000000 0.250000 Ti\n0.377533 0.377533 0.250000 Ga\n0.000000 0.000000 0.000000 Ga\n0.000000 0.000000 0.500000 Ga\n0.622467 -0.000000 0.250000 Ga\n0.622467 0.622467 0.750000 Ga\n-0.000000 0.377533 0.750000 Ga\n-0.000000 0.622467 0.250000 Ga\n0.377533 -0.000000 0.750000 Ga\n",
"nsites": 18,
"nelements": 2,
"elements": [
"Ti",
"Ga"
],
"chemical_system": "Ga-Ti",
"density": 5.968034963228784,
"density_atomic": 0.06241726494263487,
"volume": 288.38174848806744,
"volume_molar": 9.648197122278107,
"formula_full": "Ti10 Ga8",
"formula_reduced": "Ti5Ga4",
"formula_anonymous": "A4B5",
"energy_above_hull": 2.238274551851852,
"spacegroup": 193
},
{
"id": "jvasp-20125",
"created_at": "2022-09-04T14:37:28.764143Z",
"updated_at": "2022-09-04T14:37:28.764171Z",
"structure_string": "V10 S8\n1.0\n8.970531 -0.000000 0.000000\n0.000000 8.970531 -0.000000\n0.000000 0.000000 3.188173\nV S\n10 8\ndirect\n0.800664 0.120520 0.499999 V\n0.379480 0.300664 0.000000 V\n0.500000 0.500000 0.499999 V\n0.620520 0.699335 0.000000 V\n0.300664 0.620520 0.000000 V\n0.699335 0.379480 0.000000 V\n0.199335 0.879480 0.499999 V\n0.000000 0.000000 0.000000 V\n0.120520 0.199335 0.499999 V\n0.879480 0.800664 0.499999 V\n0.563027 0.227823 0.499999 S\n0.936973 0.272177 0.000000 S\n0.272177 0.063027 0.000000 S\n0.063027 0.727823 0.000000 S\n0.727823 0.936973 0.000000 S\n0.436973 0.772177 0.499999 S\n0.772177 0.563027 0.499999 S\n0.227823 0.436973 0.499999 S\n",
"nsites": 18,
"nelements": 2,
"elements": [
"V",
"S"
],
"chemical_system": "S-V",
"density": 4.957501230253753,
"density_atomic": 0.07016076615665977,
"volume": 256.55364081698264,
"volume_molar": 8.583345208279725,
"formula_full": "V10 S8",
"formula_reduced": "V5S4",
"formula_anonymous": "A4B5",
"energy_above_hull": 3.752561222222223,
"spacegroup": 87
},
{
"id": "jvasp-16211",
"created_at": "2022-09-04T14:37:07.431185Z",
"updated_at": "2022-09-04T14:37:07.431194Z",
"structure_string": "V5 Te4\n1.0\n3.870968 0.000000 0.976571\n1.935484 6.848603 0.488285\n0.260203 0.000000 7.128827\nV Te\n5 4\ndirect\n0.000000 0.000000 0.000000 V\n0.340915 0.070153 0.248016 V\n0.588931 0.751984 0.070154 V\n0.411068 0.248016 0.929847 V\n0.659084 0.929846 0.751985 V\n0.074139 0.202441 0.649281 Te\n0.723420 0.350719 0.202442 Te\n0.276579 0.649281 0.797559 Te\n0.925860 0.797558 0.350720 Te\n",
"nsites": 9,
"nelements": 2,
"elements": [
"V",
"Te"
],
"chemical_system": "Te-V",
"density": 6.784995112912095,
"density_atomic": 0.04806406429944842,
"volume": 187.25008238854414,
"volume_molar": 12.52940392739344,
"formula_full": "V5 Te4",
"formula_reduced": "V5Te4",
"formula_anonymous": "A4B5",
"energy_above_hull": 3.3108713407407406,
"spacegroup": 87
},
{
"id": "jvasp-4397",
"created_at": "2022-09-04T14:36:47.577421Z",
"updated_at": "2022-09-04T14:36:47.577456Z",
"structure_string": "P16 Se20\n1.0\n6.676504 0.000000 0.000000\n0.000000 11.210675 0.000000\n0.000000 0.000000 12.927410\nP Se\n16 20\ndirect\n0.492718 0.463584 0.441908 P\n0.962456 0.985529 0.326325 P\n0.037544 0.485529 0.673675 P\n0.537543 0.985529 0.826325 P\n0.901179 0.152415 0.098303 P\n0.098821 0.652415 0.901697 P\n0.598820 0.152415 0.598303 P\n0.401179 0.652415 0.401697 P\n0.462456 0.485529 0.173675 P\n0.689090 0.517430 0.891611 P\n0.189090 0.017430 0.608389 P\n0.810909 0.517430 0.391611 P\n0.992717 0.963584 0.058092 P\n0.007282 0.463584 0.941908 P\n0.507282 0.963584 0.558092 P\n0.310909 0.017430 0.108389 P\n0.173598 0.664747 0.728286 Se\n0.823105 0.244760 0.508794 Se\n0.176894 0.744760 0.491206 Se\n0.224330 0.215289 0.066996 Se\n0.775670 0.715290 0.933004 Se\n0.275670 0.215289 0.566996 Se\n0.724329 0.715290 0.433004 Se\n0.826401 0.164747 0.271714 Se\n0.673598 0.164747 0.771714 Se\n0.639488 0.860781 0.691612 Se\n0.298664 -0.000733 0.286363 Se\n0.701336 0.499268 0.713637 Se\n0.201336 -0.000733 0.786363 Se\n0.798663 0.499268 0.213637 Se\n0.860511 0.860781 0.191612 Se\n0.139488 0.360781 0.808388 Se\n0.323105 0.744760 0.991206 Se\n0.360511 0.360781 0.308388 Se\n0.326401 0.664747 0.228286 Se\n0.676894 0.244760 0.008794 Se\n",
"nsites": 36,
"nelements": 2,
"elements": [
"P",
"Se"
],
"chemical_system": "P-Se",
"density": 3.5606459465697013,
"density_atomic": 0.037205753282531236,
"volume": 967.5922894673024,
"volume_molar": 16.186047126285445,
"formula_full": "P16 Se20",
"formula_reduced": "P4Se5",
"formula_anonymous": "A4B5",
"energy_above_hull": 2.4770720925925924,
"spacegroup": 33
},
{
"id": "jvasp-101986",
"created_at": "2022-09-04T14:36:44.088921Z",
"updated_at": "2022-09-04T14:36:44.088948Z",
"structure_string": "H16 C20\n1.0\n7.112449 0.000000 -3.096578\n0.000000 5.850792 0.000000\n-0.080266 0.000000 7.941571\nH C\n16 20\ndirect\n0.475855 0.069372 0.840776 H\n0.345912 0.809954 0.380407 H\n0.654088 0.190046 0.619593 H\n0.654088 0.309954 0.119593 H\n0.978474 0.078067 0.830424 H\n0.021526 0.921932 0.169575 H\n0.021525 0.578067 0.669575 H\n0.978474 0.421933 0.330424 H\n0.345911 0.690046 0.880407 H\n0.720008 0.832333 0.907422 H\n0.720008 0.667666 0.407422 H\n0.279991 0.332333 0.592577 H\n0.475856 0.430627 0.340776 H\n0.524144 0.569372 0.659224 H\n0.524144 0.930627 0.159224 H\n0.279992 0.167666 0.092577 H\n0.962858 0.608423 0.011158 C\n0.740529 0.194301 0.229512 C\n0.259470 0.805699 0.770488 C\n0.921496 0.242790 0.846364 C\n0.078503 0.757210 0.153636 C\n0.078503 0.742790 0.653636 C\n0.921497 0.257210 0.346364 C\n0.037141 0.391577 0.988842 C\n0.962858 0.891576 0.511158 C\n0.667068 0.980094 0.251707 C\n0.224421 0.332721 0.110105 C\n0.775579 0.667279 0.889894 C\n0.775579 0.832721 0.389895 C\n0.224420 0.167279 0.610105 C\n0.332932 0.480094 0.248293 C\n0.667067 0.519906 0.751707 C\n0.740529 0.305699 0.729511 C\n0.332932 0.019906 0.748293 C\n0.037142 0.108423 0.488842 C\n0.259471 0.694301 0.270488 C\n",
"nsites": 36,
"nelements": 2,
"elements": [
"H",
"C"
],
"chemical_system": "C-H",
"density": 1.2937258642830565,
"density_atomic": 0.10941516560956237,
"volume": 329.0220308989211,
"volume_molar": 5.503936064484368,
"formula_full": "H16 C20",
"formula_reduced": "H4C5",
"formula_anonymous": "A4B5",
"energy_above_hull": 5.318262222222223,
"spacegroup": 14
},
{
"id": "jvasp-18796",
"created_at": "2022-09-04T14:36:47.383007Z",
"updated_at": "2022-09-04T14:36:47.383031Z",
"structure_string": "V4 Zn5\n1.0\n3.109228 0.000000 0.795527\n1.554614 6.267514 0.397763\n0.001053 0.000000 6.469681\nV Zn\n4 5\ndirect\n0.344282 0.655717 0.655717 V\n-0.000001 0.344283 0.655717 V\n-0.000001 0.655717 0.344283 V\n0.655717 0.344283 0.344283 V\n0.000000 0.000000 0.000000 Zn\n0.330355 -0.000000 0.339288 Zn\n0.669644 0.660711 0.000000 Zn\n0.330355 0.339288 0.000000 Zn\n0.669644 -0.000000 0.660712 Zn\n",
"nsites": 9,
"nelements": 2,
"elements": [
"V",
"Zn"
],
"chemical_system": "V-Zn",
"density": 6.991596355439872,
"density_atomic": 0.07138876109142622,
"volume": 126.07026459632591,
"volume_molar": 8.43569865610577,
"formula_full": "V4 Zn5",
"formula_reduced": "V4Zn5",
"formula_anonymous": "A4B5",
"energy_above_hull": 1.3275803481481483,
"spacegroup": 139
},
{
"id": "jvasp-48233",
"created_at": "2022-09-04T14:35:55.588461Z",
"updated_at": "2022-09-04T14:35:55.588488Z",
"structure_string": "Li4 Mn5 O10\n1.0\n-5.033852 -0.250445 -0.707174\n0.566796 4.864255 0.019543\n-1.270198 -2.288635 -7.009651\nLi Mn O\n4 5 10\ndirect\n0.487348 0.887073 0.295194 Li\n0.487366 0.288450 0.098832 Li\n0.485383 0.505905 0.525845 Li\n0.485363 0.104585 0.722217 Li\n0.983703 -0.010037 0.008970 Mn\n-0.010104 0.594077 0.209435 Mn\n0.982800 0.798898 0.611626 Mn\n0.986357 0.196487 0.410523 Mn\n0.988993 0.403014 0.812078 Mn\n0.206906 0.750452 0.762890 O\n0.767545 0.445284 0.651866 O\n0.213970 0.546297 0.367415 O\n0.759568 0.245707 0.255405 O\n0.765789 0.642522 0.058167 O\n0.758734 0.846683 0.453638 O\n0.205162 0.947679 0.169175 O\n0.213134 0.147275 0.565651 O\n0.205695 0.336711 -0.032714 O\n0.766997 0.056266 0.853769 O\n",
"nsites": 19,
"nelements": 3,
"elements": [
"Li",
"Mn",
"O"
],
"chemical_system": "Li-Mn-O",
"density": 4.5990560008773445,
"density_atomic": 0.11379156868632545,
"volume": 166.97194897079635,
"volume_molar": 5.292255682493015,
"formula_full": "Li4 Mn5 O10",
"formula_reduced": "Li4Mn5O10",
"formula_anonymous": "A4B5C10",
"energy_above_hull": 3.085177958257713,
"spacegroup": 2
},
{
"id": "jvasp-47769",
"created_at": "2022-09-04T14:35:53.248835Z",
"updated_at": "2022-09-04T14:35:53.248863Z",
"structure_string": "Li4 Fe5 O10\n1.0\n4.913303 -0.021832 0.029132\n0.885713 4.908905 -0.017658\n2.433412 2.035554 6.829889\nLi Fe O\n4 5 10\ndirect\n0.226558 0.497139 0.565721 Li\n0.502477 0.013472 0.494018 Li\n0.602632 0.509636 0.785905 Li\n0.788551 0.500056 0.407798 Li\n0.111718 0.995628 0.307402 Fe\n-0.007027 0.508833 0.010357 Fe\n0.689114 -0.002164 0.106974 Fe\n0.301372 0.997604 0.897975 Fe\n0.898053 0.001197 0.692896 Fe\n0.651915 0.777820 0.940347 O\n0.776250 0.223911 0.241437 O\n0.551519 0.224828 0.667115 O\n0.452498 0.780219 0.336481 O\n0.040390 0.783206 0.146035 O\n0.344313 0.222385 0.052299 O\n0.123766 0.222159 0.460546 O\n0.874318 0.770633 0.543746 O\n0.233670 0.763978 0.759263 O\n0.948089 0.219670 0.858604 O\n",
"nsites": 19,
"nelements": 3,
"elements": [
"Li",
"Fe",
"O"
],
"chemical_system": "Fe-Li-O",
"density": 4.706966121695204,
"density_atomic": 0.11533058770805706,
"volume": 164.7438062840345,
"volume_molar": 5.2216336356875175,
"formula_full": "Li4 Fe5 O10",
"formula_reduced": "Li4(FeO2)5",
"formula_anonymous": "A4B5C10",
"energy_above_hull": 2.834623289473684,
"spacegroup": 1
}
]
}