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{
"id": "jvasp-103397",
"created_at": "2022-09-04T14:38:39.807912Z",
"updated_at": "2022-09-04T14:38:39.807934Z",
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{
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"structure_string": "Li8 Mn4 O8 F4\n1.0\n5.119867 0.052607 -0.710409\n-2.524027 4.345889 0.289626\n0.016098 -0.144703 9.676202\nLi Mn O F\n8 4 8 4\ndirect\n0.187087 0.862800 0.506230 Li\n-0.000000 0.500000 0.000000 Li\n0.064494 0.138932 0.251812 Li\n0.678077 0.875864 0.992157 Li\n0.500000 0.500000 0.500000 Li\n0.321924 0.124139 0.007843 Li\n0.935506 0.861069 0.748188 Li\n0.812914 0.137201 0.493770 Li\n0.577354 0.155712 0.750453 Mn\n0.751411 0.491519 0.249352 Mn\n0.248590 0.508482 0.750648 Mn\n0.422647 0.844290 0.249547 Mn\n0.057768 0.805436 0.148232 O\n0.289929 0.818208 0.872579 O\n0.521872 0.828556 0.635538 O\n0.254610 0.195528 0.643822 O\n0.745391 0.804473 0.356178 O\n0.478129 0.171445 0.364462 O\n0.710072 0.181794 0.127422 O\n0.942233 0.194566 0.851768 O\n0.352444 0.487617 0.118418 F\n0.124043 0.468635 0.389665 F\n0.647557 0.512385 0.881582 F\n0.875958 0.531366 0.610335 F\n",
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{
"id": "jvasp-29165",
"created_at": "2022-09-04T14:38:34.561412Z",
"updated_at": "2022-09-04T14:38:34.561439Z",
"structure_string": "Mo2 W2 Se4 S4\n1.0\n3.258384 -0.000023 -0.000446\n-1.629180 2.821858 0.002103\n0.003424 -0.016448 25.723006\nMo W Se S\n2 2 4 4\ndirect\n0.332368 0.665800 0.996272 Mo\n0.333876 0.667121 0.505096 Mo\n0.666551 0.333440 0.255503 W\n0.667195 0.333639 0.746048 W\n0.333224 0.666769 0.321912 Se\n0.665721 0.332491 0.930272 Se\n0.665693 0.332447 0.062284 Se\n0.333218 0.666780 0.189074 Se\n0.333841 0.666935 0.806446 S\n0.667212 0.333804 0.444992 S\n0.667204 0.333773 0.565176 S\n0.333885 0.667009 0.685674 S\n",
"nsites": 12,
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{
"id": "jvasp-29097",
"created_at": "2022-09-04T14:38:34.839917Z",
"updated_at": "2022-09-04T14:38:34.839943Z",
"structure_string": "Te4 Mo2 W2 Se4\n1.0\n3.451571 0.000000 0.000000\n-1.725785 2.989154 -0.000026\n0.000000 -0.000339 38.803108\nTe Mo W Se\n4 2 2 4\ndirect\n0.666642 0.333284 0.046363 Te\n0.666642 0.333283 0.421526 Te\n0.666644 0.333288 0.141790 Te\n0.666645 0.333291 0.517708 Te\n0.333307 0.666615 0.093921 Mo\n0.666679 0.333361 0.281878 Mo\n0.333311 0.666624 0.469715 W\n0.666698 0.333398 0.657564 W\n0.333348 0.666698 0.323829 Se\n0.333360 0.666724 0.699512 Se\n0.333348 0.666701 0.239695 Se\n0.333361 0.666725 0.615247 Se\n",
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"formula_full": "Te4 Mo2 W2 Se4",
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{
"id": "jvasp-28972",
"created_at": "2022-09-04T14:37:15.198301Z",
"updated_at": "2022-09-04T14:37:15.198327Z",
"structure_string": "Mo2 W2 Se4 S4\n1.0\n3.257344 0.000000 0.000000\n-1.628672 2.821021 0.001315\n0.000000 0.014425 31.727910\nMo W Se S\n2 2 4 4\ndirect\n0.334940 0.669881 0.476483 Mo\n0.665632 0.331264 0.275028 Mo\n0.333505 0.667010 0.072457 W\n0.665998 0.331998 0.678966 W\n0.332198 0.664397 0.328552 Se\n0.332185 0.664371 0.732747 Se\n0.332290 0.664581 0.221530 Se\n0.332972 0.665944 0.625066 Se\n0.667086 0.334171 0.023537 S\n0.668567 0.337134 0.427723 S\n0.666635 0.333271 0.121431 S\n0.667985 0.335970 0.525227 S\n",
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{
"id": "jvasp-28973",
"created_at": "2022-09-04T14:37:19.989695Z",
"updated_at": "2022-09-04T14:37:19.989721Z",
"structure_string": "Te4 Mo2 W2 S4\n1.0\n3.362636 -0.000001 0.000009\n-1.681320 2.912154 0.000036\n0.000083 0.000483 36.920247\nTe Mo W S\n4 2 2 4\ndirect\n0.333245 0.666516 0.327351 Te\n0.666755 0.333482 0.424107 Te\n0.666722 0.333470 0.526764 Te\n0.333277 0.666528 0.224695 Te\n0.333406 0.666813 0.475422 Mo\n0.666594 0.333185 0.276036 Mo\n0.333346 0.666665 0.093695 W\n0.666654 0.333334 0.657763 W\n0.333314 0.666647 0.698917 S\n0.666685 0.333351 0.052541 S\n0.666677 0.333307 0.134896 S\n0.333322 0.666692 0.616562 S\n",
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"formula_full": "Te4 Mo2 W2 S4",
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{
"id": "jvasp-35165",
"created_at": "2022-09-04T14:37:31.240607Z",
"updated_at": "2022-09-04T14:37:31.240647Z",
"structure_string": "Li4 P2 N2 O4\n1.0\n0.000000 0.000000 -4.724073\n-4.515835 -2.695217 0.000000\n-4.515835 2.695217 0.000000\nLi P N O\n4 2 2 4\ndirect\n0.497804 0.007965 0.325193 Li\n0.497804 0.674808 0.992036 Li\n0.997804 0.992036 0.674808 Li\n0.997804 0.325193 0.007965 Li\n0.500243 0.344375 0.655626 P\n0.000243 0.655626 0.344375 P\n0.656098 0.615624 0.384377 N\n0.156098 0.384377 0.615624 N\n0.583525 0.332464 0.948406 O\n0.583525 0.051595 0.667537 O\n0.083525 0.667537 0.051595 O\n0.083525 0.948406 0.332464 O\n",
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{
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"created_at": "2022-09-04T14:37:28.037149Z",
"updated_at": "2022-09-04T14:37:28.037180Z",
"structure_string": "Li1 Y1 Cu2 P2\n1.0\n3.995806 0.000012 -0.000012\n-1.997893 3.460452 0.000000\n-0.000007 -0.000004 6.636064\nLi Y Cu P\n1 1 2 2\ndirect\n-0.000000 0.000001 0.500000 Li\n0.000000 0.000000 0.000000 Y\n0.666667 0.333333 0.327327 Cu\n0.333334 0.666667 0.672673 Cu\n0.666663 0.333332 0.740129 P\n0.333338 0.666668 0.259871 P\n",
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},
{
"id": "jvasp-28978",
"created_at": "2022-09-04T14:37:31.144887Z",
"updated_at": "2022-09-04T14:37:31.144903Z",
"structure_string": "Mo2 W2 Se4 S4\n1.0\n3.256000 0.000000 0.000000\n-1.628000 2.819787 0.000041\n0.000000 0.000317 34.027522\nMo W Se S\n2 2 4 4\ndirect\n0.333506 0.667012 0.473451 Mo\n0.666495 0.332990 0.278007 Mo\n0.333278 0.666557 0.088817 W\n0.666722 0.333445 0.662641 W\n0.333162 0.666326 0.327935 Se\n0.666839 0.333676 0.423523 Se\n0.666834 0.333667 0.523363 Se\n0.333166 0.666335 0.228095 Se\n0.333388 0.666778 0.708273 S\n0.666613 0.333224 0.043185 S\n0.666606 0.333212 0.134498 S\n0.333394 0.666790 0.616960 S\n",
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{
"id": "jvasp-29189",
"created_at": "2022-09-04T14:37:07.072790Z",
"updated_at": "2022-09-04T14:37:07.072804Z",
"structure_string": "Te4 Mo2 W2 Se4\n1.0\n3.444124 0.000000 0.000002\n-1.722062 2.982671 -0.000010\n0.000019 -0.000111 36.664457\nTe Mo W Se\n4 2 2 4\ndirect\n0.333324 0.666662 0.332310 Te\n0.333352 0.666693 0.708076 Te\n0.333323 0.666655 0.230934 Te\n0.333349 0.666687 0.606239 Te\n0.333324 0.666644 0.094764 Mo\n0.666653 0.333321 0.281625 Mo\n0.333340 0.666680 0.469331 W\n0.666677 0.333346 0.657196 W\n0.666654 0.333305 0.050225 Se\n0.666671 0.333341 0.424540 Se\n0.666657 0.333311 0.139393 Se\n0.666676 0.333350 0.514115 Se\n",
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{
"id": "jvasp-28845",
"created_at": "2022-09-04T14:37:10.049302Z",
"updated_at": "2022-09-04T14:37:10.049324Z",
"structure_string": "Te2 W4 Se2 S4\n1.0\n3.314439 0.000002 0.000001\n-1.657218 2.870383 -0.000032\n0.000008 -0.000420 38.881508\nTe W Se S\n2 4 2 4\ndirect\n0.666688 0.333376 0.419319 Te\n0.666700 0.333400 0.518369 Te\n0.333321 0.666643 0.093955 W\n0.333361 0.666721 0.468872 W\n0.666695 0.333390 0.281141 W\n0.666622 0.333245 0.658978 W\n0.333294 0.666588 0.702226 Se\n0.333280 0.666561 0.615617 Se\n0.333369 0.666740 0.320615 S\n0.666655 0.333307 0.054592 S\n0.666659 0.333316 0.133400 S\n0.333352 0.666702 0.241665 S\n",
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{
"id": "jvasp-9794",
"created_at": "2022-09-04T14:37:19.203699Z",
"updated_at": "2022-09-04T14:37:19.203724Z",
"structure_string": "K4 Li2 Al2 P4\n1.0\n5.699446 0.000000 -2.187648\n-0.850306 5.651642 -2.215288\n0.004479 0.020183 8.529834\nK Li Al P\n4 2 2 4\ndirect\n0.824470 0.098666 0.648938 K\n0.175530 0.901334 0.351060 K\n0.675531 0.449727 0.351061 K\n0.324469 0.550272 0.648938 K\n0.250000 0.500000 -0.000000 Li\n0.750000 0.500000 -0.000000 Li\n0.250000 -0.000000 -0.000000 Al\n0.750001 -0.000000 -0.000000 Al\n0.910036 0.686999 0.820073 P\n0.410037 0.133074 0.820073 P\n0.589964 0.866926 0.179926 P\n0.089964 0.313000 0.179926 P\n",
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}