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=20",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-nelements&page=18",
"results": [
{
"id": "jvasp-85686",
"created_at": "2022-09-04T14:36:02.609312Z",
"updated_at": "2022-09-04T14:36:02.609326Z",
"structure_string": "Na2 Zn1 H4 Se2 O10\n1.0\n5.718319 -0.007489 -1.803163\n-2.683877 6.545901 -1.110686\n-0.083518 0.000340 5.584505\nNa Zn H Se O\n2 1 4 2 10\ndirect\n0.723696 0.247627 0.346428 Na\n0.276303 0.752372 0.653573 Na\n0.000000 0.000000 0.000000 Zn\n0.871276 0.607841 0.853496 H\n0.128723 0.392159 0.146505 H\n0.154422 0.701474 0.078377 H\n0.845577 0.298526 0.921624 H\n0.661036 0.758760 0.324090 Se\n0.338963 0.241240 0.675911 Se\n0.641580 0.371568 0.716348 O\n0.358419 0.628432 0.283653 O\n0.175180 0.389574 0.655124 O\n0.824819 0.610425 0.344877 O\n0.652523 0.862777 0.070823 O\n0.773256 0.954916 0.594958 O\n0.347476 0.137223 0.929177 O\n0.037084 0.727898 0.925720 O\n0.226743 0.045083 0.405042 O\n0.962915 0.272102 0.074280 O\n",
"nsites": 19,
"nelements": 5,
"elements": [
"Na",
"Zn",
"H",
"Se",
"O"
],
"chemical_system": "H-Na-O-Se-Zn",
"density": 3.460433143321408,
"density_atomic": 0.09137174130133432,
"volume": 207.94175233390828,
"volume_molar": 6.590813170715023,
"formula_full": "Na2 Zn1 H4 Se2 O10",
"formula_reduced": "Na2ZnH4(SeO5)2",
"formula_anonymous": "AB2C2D4E10",
"energy_above_hull": 2.2064184280701755,
"spacegroup": 2
},
{
"id": "jvasp-29106",
"created_at": "2022-09-04T14:35:53.007467Z",
"updated_at": "2022-09-04T14:35:53.007496Z",
"structure_string": "Te4 Mo3 W1 Se2 S2\n1.0\n3.400375 -0.000000 0.000000\n-1.700188 2.944812 -0.000009\n-0.000002 -0.000109 38.721049\nTe Mo W Se S\n4 3 1 2 2\ndirect\n0.333350 0.666703 0.330298 Te\n0.666645 0.333291 0.045456 Te\n0.666643 0.333288 0.142238 Te\n0.333348 0.666699 0.233474 Te\n0.333311 0.666623 0.093796 Mo\n0.333314 0.666627 0.469679 Mo\n0.666683 0.333370 0.281885 Mo\n0.666689 0.333381 0.657535 W\n0.666642 0.333285 0.427044 Se\n0.666649 0.333300 0.512317 Se\n0.333359 0.666720 0.696458 S\n0.333354 0.666708 0.618568 S\n",
"nsites": 12,
"nelements": 5,
"elements": [
"Te",
"Mo",
"W",
"Se",
"S"
],
"chemical_system": "Mo-S-Se-Te-W",
"density": 5.156841195899781,
"density_atomic": 0.030949222482404996,
"volume": 387.7318729677989,
"volume_molar": 19.458132634587702,
"formula_full": "Te4 Mo3 W1 Se2 S2",
"formula_reduced": "Te4Mo3W(SeS)2",
"formula_anonymous": "AB2C2D3E4",
"energy_above_hull": 3.636738791666666,
"spacegroup": 156
},
{
"id": "jvasp-43994",
"created_at": "2022-09-04T14:36:02.762582Z",
"updated_at": "2022-09-04T14:36:02.762603Z",
"structure_string": "Li1 V1 P4 H4 O14\n1.0\n5.304672 0.143520 -0.015167\n2.611446 6.508044 -0.347920\n1.192485 0.346923 7.517687\nLi V P H O\n1 1 4 4 14\ndirect\n0.000000 0.000000 0.000000 Li\n0.000001 0.500000 0.000000 V\n0.332983 0.238609 0.314183 P\n0.372816 0.651168 0.226890 P\n0.627184 0.348831 0.773110 P\n0.667017 0.761390 0.685817 P\n0.055119 0.811481 0.446140 H\n0.673599 0.940778 0.338206 H\n0.326401 0.059221 0.661794 H\n0.944881 0.188518 0.553860 H\n0.823331 0.308095 0.911650 O\n0.653643 0.652083 0.156706 O\n0.579396 0.568012 0.683294 O\n0.759803 0.186173 0.619247 O\n0.382103 0.943811 0.753224 O\n0.617897 0.056188 0.246776 O\n0.216570 0.208813 0.501775 O\n0.420604 0.431987 0.316706 O\n0.346358 0.347916 0.843294 O\n0.176669 0.691904 0.088350 O\n0.783430 0.791186 0.498225 O\n0.133452 0.279855 0.179768 O\n0.240198 0.813825 0.380753 O\n0.866549 0.720144 0.820232 O\n",
"nsites": 24,
"nelements": 5,
"elements": [
"Li",
"V",
"P",
"H",
"O"
],
"chemical_system": "H-Li-O-P-V",
"density": 2.643702641552617,
"density_atomic": 0.0932399072606187,
"volume": 257.4005134187512,
"volume_molar": 6.458758847933286,
"formula_full": "Li1 V1 P4 H4 O14",
"formula_reduced": "LiVP4(H2O7)2",
"formula_anonymous": "ABC4D4E14",
"energy_above_hull": 3.159298966666667,
"spacegroup": 2
},
{
"id": "jvasp-28648",
"created_at": "2022-09-04T14:36:59.713444Z",
"updated_at": "2022-09-04T14:36:59.713475Z",
"structure_string": "Te2 Mo3 W1 Se2 S4\n1.0\n3.313953 0.000000 0.000000\n-1.656977 2.869845 -0.004285\n0.000000 0.038137 26.233704\nTe Mo W Se S\n2 3 1 2 4\ndirect\n0.332758 0.665519 0.823814 Te\n0.332723 0.665448 0.677621 Te\n0.333062 0.666126 0.007872 Mo\n0.334396 0.668794 0.493608 Mo\n0.666076 0.332154 0.750718 Mo\n0.666472 0.332946 0.250721 W\n0.333162 0.666327 0.315023 Se\n0.333099 0.666202 0.186413 Se\n0.666380 0.332763 0.949634 S\n0.667725 0.335451 0.435370 S\n0.666408 0.332816 0.066108 S\n0.667726 0.335452 0.551844 S\n",
"nsites": 12,
"nelements": 5,
"elements": [
"Te",
"Mo",
"W",
"Se",
"S"
],
"chemical_system": "Mo-S-Se-Te-W",
"density": 6.742335335533649,
"density_atomic": 0.048096769078106005,
"volume": 249.49700842717283,
"volume_molar": 12.520884199561173,
"formula_full": "Te2 Mo3 W1 Se2 S4",
"formula_reduced": "Te2Mo3W(SeS2)2",
"formula_anonymous": "AB2C2D3E4",
"energy_above_hull": 3.819604997222223,
"spacegroup": 187
},
{
"id": "jvasp-96514",
"created_at": "2022-09-04T14:36:02.819547Z",
"updated_at": "2022-09-04T14:36:02.819575Z",
"structure_string": "Cd1 Hg1 C4 S4 N4\n1.0\n3.920907 0.000195 1.026084\n1.960836 8.190248 0.513003\n-0.111170 -0.000038 8.437556\nCd Hg C S N\n1 1 4 4 4\ndirect\n0.750066 0.499964 0.499935 Cd\n-0.000036 0.000009 0.000015 Hg\n0.117273 0.647466 0.828952 C\n0.235501 0.171047 0.647469 C\n0.593473 0.352534 0.171054 C\n0.053757 0.828965 0.352513 C\n0.165691 0.998397 0.284635 S\n0.449291 0.001787 0.715493 S\n0.835687 0.715417 0.998323 S\n0.549127 0.284605 0.001742 S\n0.975180 0.707087 0.403012 N\n0.317878 0.596891 0.707128 N\n0.085286 0.292798 0.596872 N\n0.621836 0.403035 0.292855 N\n",
"nsites": 14,
"nelements": 5,
"elements": [
"Cd",
"Hg",
"C",
"S",
"N"
],
"chemical_system": "C-Cd-Hg-N-S",
"density": 3.3305733486291405,
"density_atomic": 0.05149179989795694,
"volume": 271.88795163005136,
"volume_molar": 11.69533939760172,
"formula_full": "Cd1 Hg1 C4 S4 N4",
"formula_reduced": "CdHgC4(SN)4",
"formula_anonymous": "ABC4D4E4",
"energy_above_hull": 4.315908382142857,
"spacegroup": 82
},
{
"id": "jvasp-48932",
"created_at": "2022-09-04T14:35:52.588779Z",
"updated_at": "2022-09-04T14:35:52.588809Z",
"structure_string": "Li3 V1 Cr1 P4 O14\n1.0\n4.942688 -0.007049 0.022689\n-2.258042 6.635253 -0.010769\n-0.021402 -0.078883 8.180230\nLi V Cr P O\n3 1 1 4 14\ndirect\n0.829131 0.341626 0.137896 Li\n0.284692 0.092379 0.335758 Li\n0.167264 0.661842 0.648065 Li\n0.793840 0.277505 0.506680 V\n0.216066 0.727485 0.995185 Cr\n0.596348 0.477959 0.823477 P\n0.797105 0.913662 0.206607 P\n0.210744 0.082384 0.717254 P\n0.394673 0.522671 0.316375 P\n0.196828 0.497371 0.462993 O\n0.234780 0.512102 0.154853 O\n0.381753 0.593897 0.822596 O\n0.613603 0.912981 0.059327 O\n0.621678 0.745639 0.336620 O\n0.417798 0.241374 0.845943 O\n0.799113 0.525551 0.970498 O\n0.562530 0.371183 0.313060 O\n0.753526 0.499619 0.660156 O\n0.139444 0.879961 0.803198 O\n0.876632 0.113389 0.304280 O\n0.952288 0.147123 0.685081 O\n0.383126 0.080125 0.559295 O\n0.082668 0.877266 0.173699 O\n",
"nsites": 23,
"nelements": 5,
"elements": [
"Li",
"V",
"Cr",
"P",
"O"
],
"chemical_system": "Cr-Li-O-P-V",
"density": 2.9206940817296223,
"density_atomic": 0.08577238858659052,
"volume": 268.15156228021584,
"volume_molar": 7.0210715350668105,
"formula_full": "Li3 V1 Cr1 P4 O14",
"formula_reduced": "Li3VCr(P2O7)2",
"formula_anonymous": "ABC3D4E14",
"energy_above_hull": 3.04739967826087,
"spacegroup": 1
},
{
"id": "jvasp-50980",
"created_at": "2022-09-04T14:37:00.309037Z",
"updated_at": "2022-09-04T14:37:00.309054Z",
"structure_string": "Li3 Zr1 Nb1 Te2 O12\n1.0\n5.158804 0.000681 0.001763\n-0.001896 5.512635 -0.044891\n-0.029833 -0.598221 7.549057\nLi Zr Nb Te O\n3 1 1 2 12\ndirect\n0.502072 0.050803 0.722863 Li\n0.002006 0.552648 0.729723 Li\n0.996547 0.590009 0.207298 Li\n0.000871 0.013079 0.009990 Zr\n0.501035 0.486951 0.488080 Nb\n0.502325 0.500250 0.996821 Te\n0.001376 0.992647 0.504561 Te\n0.365348 0.489270 0.247624 O\n0.189467 0.668270 0.945488 O\n0.116418 0.973250 0.268017 O\n0.688334 0.791640 0.063842 O\n0.334968 0.190362 0.935569 O\n0.690277 0.176082 0.451175 O\n0.869758 0.977892 0.740845 O\n0.300022 0.798656 0.576738 O\n0.626851 0.487152 0.752024 O\n0.819540 0.676199 0.443943 O\n0.806022 0.330332 0.072677 O\n0.186755 0.294913 0.572522 O\n",
"nsites": 19,
"nelements": 5,
"elements": [
"Li",
"Zr",
"Nb",
"Te",
"O"
],
"chemical_system": "Li-Nb-O-Te-Zr",
"density": 5.04745916912125,
"density_atomic": 0.08855893053591127,
"volume": 214.5464029999252,
"volume_molar": 6.800150728511766,
"formula_full": "Li3 Zr1 Nb1 Te2 O12",
"formula_reduced": "Li3ZrNb(TeO6)2",
"formula_anonymous": "ABC2D3E12",
"energy_above_hull": 2.719211128070175,
"spacegroup": 1
},
{
"id": "jvasp-52911",
"created_at": "2022-09-04T14:37:00.310560Z",
"updated_at": "2022-09-04T14:37:00.310585Z",
"structure_string": "Li2 As2 H4 O2 F12\n1.0\n-3.718174 5.299984 3.059206\n3.718174 -5.299984 3.059206\n3.718174 5.299984 -3.059206\nLi As H O F\n2 2 4 2 12\ndirect\n-0.000001 -0.000001 0.500000 Li\n0.000001 0.500000 -0.000000 Li\n0.500000 0.000000 0.500000 As\n0.000000 0.000000 0.000000 As\n0.194521 0.518596 0.675924 H\n0.805479 0.481404 0.324075 H\n0.657329 0.481404 0.175925 H\n0.342671 0.518596 0.824074 H\n0.171772 0.421771 0.749999 O\n0.828229 0.578229 0.250000 O\n0.084872 0.136543 0.285851 F\n0.915128 0.200980 0.051671 F\n0.350693 0.799021 0.214148 F\n0.649308 0.863457 0.448328 F\n0.915128 0.863457 0.714148 F\n0.243068 0.715622 0.527445 F\n0.688178 0.715622 0.972554 F\n0.311823 0.284378 0.027446 F\n0.756932 0.284378 0.472554 F\n0.350692 0.136543 0.551671 F\n0.084872 0.799020 0.948328 F\n0.649307 0.200979 0.785851 F\n",
"nsites": 22,
"nelements": 5,
"elements": [
"Li",
"As",
"H",
"O",
"F"
],
"chemical_system": "As-F-H-Li-O",
"density": 2.945455914693974,
"density_atomic": 0.09123252586969033,
"volume": 241.1420684704394,
"volume_molar": 6.600870361302472,
"formula_full": "Li2 As2 H4 O2 F12",
"formula_reduced": "LiAsH2OF6",
"formula_anonymous": "ABCD2E6",
"energy_above_hull": 0.8786424495454546,
"spacegroup": 74
},
{
"id": "jvasp-8413",
"created_at": "2022-09-04T14:37:06.222864Z",
"updated_at": "2022-09-04T14:37:06.222883Z",
"structure_string": "Ba1 Al1 Fe1 Cu1 O5\n1.0\n3.734589 0.000000 0.000000\n0.000000 3.734589 0.000000\n-0.000000 0.000000 7.790648\nBa Al Fe Cu O\n1 1 1 1 5\ndirect\n0.000000 0.000000 0.005583 Ba\n0.000000 0.000000 0.466074 Al\n0.500000 0.500000 0.687171 Fe\n0.500000 0.500000 0.272597 Cu\n0.000000 0.500000 0.615062 O\n0.500000 0.000000 0.615062 O\n0.000000 0.500000 0.299666 O\n0.500000 0.000000 0.299666 O\n0.500000 0.500000 0.927037 O\n",
"nsites": 9,
"nelements": 5,
"elements": [
"Ba",
"Al",
"Fe",
"Cu",
"O"
],
"chemical_system": "Al-Ba-Cu-Fe-O",
"density": 5.558134545692788,
"density_atomic": 0.08282916814065329,
"volume": 108.65737519803389,
"volume_molar": 7.270555645052144,
"formula_full": "Ba1 Al1 Fe1 Cu1 O5",
"formula_reduced": "BaAlFeCuO5",
"formula_anonymous": "ABCDE5",
"energy_above_hull": 1.96729358,
"spacegroup": 99
},
{
"id": "jvasp-95085",
"created_at": "2022-09-04T14:36:03.075010Z",
"updated_at": "2022-09-04T14:36:03.075038Z",
"structure_string": "K8 Bi4 Mo4 P4 O32\n1.0\n6.773372 0.000000 2.048018\n1.926686 10.564166 5.852640\n-0.001508 -0.031701 12.229722\nK Bi Mo P O\n8 4 4 4 32\ndirect\n0.121981 0.764915 0.424278 K\n0.621981 0.924278 0.264914 K\n0.811173 0.575722 0.235086 K\n0.878018 0.235086 0.575722 K\n0.188826 0.424278 0.764914 K\n0.311174 0.735086 0.075722 K\n0.378018 0.075722 0.735086 K\n0.688826 0.264914 0.924278 K\n0.250000 0.827826 0.672174 Bi\n0.750000 0.672175 0.827826 Bi\n0.250000 0.327826 0.172174 Bi\n0.750000 0.172174 0.327826 Bi\n0.168801 0.081199 0.081199 Mo\n0.331199 0.418802 0.418801 Mo\n0.831199 0.918802 0.918801 Mo\n0.668801 0.581199 0.581199 Mo\n0.250000 0.071827 0.428173 P\n0.750000 0.928174 0.571826 P\n0.250000 0.571827 0.928173 P\n0.750000 0.428174 0.071827 P\n0.430357 0.138555 0.338435 O\n0.413046 0.661943 0.601939 O\n0.661604 0.418826 0.643799 O\n0.160174 0.561347 0.063209 O\n0.161604 0.143800 0.918825 O\n0.676928 0.838057 0.898060 O\n0.715269 0.063210 0.561346 O\n0.913046 0.101940 0.161943 O\n0.724230 0.081175 0.856201 O\n0.215270 0.061346 0.563210 O\n0.086954 0.898061 0.838057 O\n0.823071 0.601940 0.661943 O\n0.338396 0.581175 0.356200 O\n0.660174 0.563210 0.061346 O\n0.339826 0.436791 0.938653 O\n0.907347 0.361445 0.161565 O\n0.069643 0.161565 0.361445 O\n0.323071 0.161943 0.101939 O\n0.775769 0.643800 0.418825 O\n0.224231 0.356201 0.581174 O\n0.275770 0.918826 0.143799 O\n0.176929 0.398061 0.338057 O\n0.784730 0.938654 0.436790 O\n0.569643 0.861446 0.661565 O\n0.839825 0.438654 0.936790 O\n0.284730 0.936791 0.438653 O\n0.407347 0.661565 0.861445 O\n0.092653 0.638555 0.838435 O\n0.586954 0.338057 0.398060 O\n0.592653 0.338435 0.138555 O\n0.838396 0.856201 0.081174 O\n0.930357 0.838435 0.638555 O\n",
"nsites": 52,
"nelements": 5,
"elements": [
"K",
"Bi",
"Mo",
"P",
"O"
],
"chemical_system": "Bi-K-Mo-O-P",
"density": 4.109066003309152,
"density_atomic": 0.059342960875996185,
"volume": 876.2623103464599,
"volume_molar": 10.148028799209973,
"formula_full": "K8 Bi4 Mo4 P4 O32",
"formula_reduced": "K2BiMoPO8",
"formula_anonymous": "ABCD2E8",
"energy_above_hull": 2.4097145923076924,
"spacegroup": 73
},
{
"id": "jvasp-101229",
"created_at": "2022-09-04T14:37:00.526410Z",
"updated_at": "2022-09-04T14:37:00.526427Z",
"structure_string": "Ba1 Sr1 Mg1 Te1 O6\n1.0\n4.955637 -0.000000 2.861139\n1.651879 4.672220 2.861139\n-0.000000 -0.000000 5.722277\nBa Sr Mg Te O\n1 1 1 1 6\ndirect\n0.750001 0.750000 0.750000 Ba\n0.250000 0.250000 0.250000 Sr\n0.000000 0.000000 0.000000 Mg\n0.500000 0.500000 0.500000 Te\n0.741302 0.741302 0.258699 O\n0.258699 0.741302 0.258699 O\n0.741302 0.258698 0.258699 O\n0.258699 0.258698 0.741302 O\n0.741302 0.258698 0.741302 O\n0.258699 0.741302 0.741302 O\n",
"nsites": 10,
"nelements": 5,
"elements": [
"Ba",
"Sr",
"Mg",
"Te",
"O"
],
"chemical_system": "Ba-Mg-O-Sr-Te",
"density": 5.926241880798054,
"density_atomic": 0.07547590897274108,
"volume": 132.49260772217536,
"volume_molar": 7.97889133362403,
"formula_full": "Ba1 Sr1 Mg1 Te1 O6",
"formula_reduced": "BaSrMgTeO6",
"formula_anonymous": "ABCDE6",
"energy_above_hull": 1.3913850096666665,
"spacegroup": 216
},
{
"id": "jvasp-8409",
"created_at": "2022-09-04T14:37:05.703370Z",
"updated_at": "2022-09-04T14:37:05.703379Z",
"structure_string": "Ba1 Al1 Cu1 Sn1 O5\n1.0\n3.803705 0.000000 0.000000\n0.000000 3.803705 0.000000\n0.000000 0.000000 8.573044\nBa Al Cu Sn O\n1 1 1 1 5\ndirect\n0.000000 0.000000 0.047871 Ba\n0.000000 0.000000 0.443035 Al\n0.499999 0.499999 0.283962 Cu\n0.499999 0.499999 0.697131 Sn\n0.000000 0.499999 0.589889 O\n0.499999 0.000000 0.589889 O\n0.000000 0.499999 0.299436 O\n0.499999 0.000000 0.299436 O\n0.499999 0.499999 0.937266 O\n",
"nsites": 9,
"nelements": 5,
"elements": [
"Ba",
"Al",
"Cu",
"Sn",
"O"
],
"chemical_system": "Al-Ba-Cu-O-Sn",
"density": 5.710604511704545,
"density_atomic": 0.07255941988355881,
"volume": 124.03627281534129,
"volume_molar": 8.299598824886075,
"formula_full": "Ba1 Al1 Cu1 Sn1 O5",
"formula_reduced": "BaAlCuSnO5",
"formula_anonymous": "ABCDE5",
"energy_above_hull": 1.5747209355555556,
"spacegroup": 99
}
]
}