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{
"id": "jvasp-21026",
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{
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{
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"structure_string": "Hf1 Pt1 Pb1\n1.0\n3.266609 -0.020853 0.894980\n0.021615 3.394713 0.000564\n0.014549 -1.699903 6.030643\nHf Pt Pb\n1 1 1\ndirect\n0.451585 0.551368 0.102696 Hf\n0.054830 0.943461 0.887079 Pt\n0.743583 0.255169 0.510223 Pb\n",
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{
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"structure_string": "Ca8 B8 O20\n1.0\n0.000000 7.193193 0.066067\n5.204576 0.000000 0.000000\n0.000000 -0.604763 -11.527511\nCa B O\n8 8 20\ndirect\n0.381178 0.563307 0.632637 Ca\n0.618822 0.063306 0.867363 Ca\n0.618822 0.436694 0.367363 Ca\n0.381178 0.936695 0.132637 Ca\n0.875645 0.600851 0.665290 Ca\n0.124355 0.100851 0.834710 Ca\n0.124355 0.399149 0.334710 Ca\n0.875645 0.899150 0.165290 Ca\n0.845031 0.923028 0.404644 B\n0.154968 0.423028 0.095356 B\n0.154968 0.076973 0.595356 B\n0.845032 0.576973 0.904644 B\n0.337914 0.561900 0.910984 B\n0.337914 0.938101 0.410984 B\n0.662086 0.438101 0.089016 B\n0.662086 0.061900 0.589015 B\n0.409341 0.418745 0.825008 O\n0.145436 0.645379 0.156370 O\n0.854563 0.145378 0.343629 O\n0.106147 0.306192 0.641841 O\n0.893853 0.806192 0.858159 O\n0.893853 0.693809 0.358159 O\n0.106147 0.193809 0.141841 O\n0.590659 0.918746 0.674991 O\n0.409341 0.081255 0.325008 O\n0.230322 0.406081 0.985026 O\n0.643591 0.320514 0.571605 O\n0.356409 0.820515 0.928394 O\n0.356409 0.679486 0.428394 O\n0.643591 0.179486 0.071605 O\n0.769678 0.593920 0.014973 O\n0.230321 0.093919 0.485027 O\n0.145437 0.854622 0.656370 O\n0.769678 0.906081 0.514973 O\n0.590659 0.581255 0.174991 O\n0.854563 0.354622 0.843629 O\n",
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{
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"created_at": "2022-09-04T14:37:56.771674Z",
"updated_at": "2022-09-04T14:37:56.771693Z",
"structure_string": "Li2 Cr2 P2 O8 F2\n1.0\n5.133056 -0.015572 -0.003959\n-0.761002 5.239473 0.001751\n-2.262875 -2.437561 6.332492\nLi Cr P O F\n2 2 2 8 2\ndirect\n0.269199 0.618530 0.195925 Li\n0.730801 0.381470 0.804074 Li\n0.000000 0.000000 0.000000 Cr\n-0.000001 -0.000000 0.500000 Cr\n0.320611 0.641605 0.761541 P\n0.679389 0.358395 0.238459 P\n0.312813 0.337440 0.658610 O\n0.687187 0.662559 0.341389 O\n0.370704 0.236501 0.073393 O\n0.748457 0.217506 0.400215 O\n0.629296 0.763498 0.926606 O\n0.251543 0.782493 0.599784 O\n0.111137 0.660397 0.881569 O\n0.888862 0.339603 0.118431 O\n0.132340 0.938006 0.265902 F\n0.867660 0.061993 0.734098 F\n",
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"created_at": "2022-09-04T14:37:12.365538Z",
"updated_at": "2022-09-04T14:37:12.365568Z",
"structure_string": "Ca4 V4 O10\n1.0\n0.000000 5.281340 -0.000037\n3.897691 0.000000 0.000000\n0.000000 -0.000130 -10.307977\nCa V O\n4 4 10\ndirect\n0.786218 0.500000 0.124545 Ca\n0.213781 0.500000 0.875454 Ca\n0.286219 0.500000 0.375455 Ca\n0.713778 0.500000 0.624546 Ca\n0.775956 0.000000 0.375024 V\n0.224044 0.000000 0.624978 V\n0.724042 0.000000 0.875023 V\n0.275959 0.000000 0.124976 V\n0.790586 0.500000 0.388208 O\n0.105037 0.000000 0.289818 O\n0.290585 0.500000 0.111793 O\n0.709417 0.500000 0.888207 O\n0.499999 0.000000 0.499999 O\n0.394965 0.000000 0.789817 O\n0.894963 0.000000 0.710183 O\n0.000000 0.000000 0.000001 O\n0.605036 0.000000 0.210183 O\n0.209416 0.500000 0.611794 O\n",
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{
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"created_at": "2022-09-04T14:36:57.208782Z",
"updated_at": "2022-09-04T14:36:57.208803Z",
"structure_string": "Te2 Mo2 Se2\n1.0\n3.450717 -0.000000 0.000000\n-1.725359 2.988409 0.000000\n0.000000 0.000000 13.723963\nTe Mo Se\n2 2 2\ndirect\n0.333334 0.666667 0.870467 Te\n0.666667 0.333333 0.129533 Te\n0.333334 0.666667 0.265821 Mo\n0.666667 0.333333 0.734178 Mo\n0.666667 0.333333 0.384027 Se\n0.333334 0.666667 0.615973 Se\n",
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{
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"created_at": "2022-09-04T14:38:11.270848Z",
"updated_at": "2022-09-04T14:38:11.270882Z",
"structure_string": "Li4 Fe2 Ni6 O16\n1.0\n5.650458 -0.000021 0.000161\n-2.825247 4.893470 -0.000322\n-0.000356 0.000617 9.070651\nLi Fe Ni O\n4 2 6 16\ndirect\n0.333330 0.666674 0.898507 Li\n0.999891 0.999956 0.995272 Li\n0.000108 0.000064 0.495272 Li\n0.666670 0.333343 0.398507 Li\n0.333369 0.666695 0.493256 Fe\n0.666630 0.333325 0.993256 Fe\n0.830372 0.169701 0.713699 Ni\n0.830371 0.660696 0.713699 Ni\n0.339380 0.169700 0.713702 Ni\n0.169628 0.339329 0.213699 Ni\n0.169628 0.830326 0.213699 Ni\n0.660620 0.830318 0.213702 Ni\n0.332028 0.166028 0.091452 O\n0.833894 0.667885 0.091484 O\n0.666713 0.333370 0.611582 O\n0.519857 0.039673 0.844811 O\n0.519848 0.480200 0.844807 O\n0.667971 0.834000 0.591452 O\n0.480143 0.519816 0.344811 O\n0.039658 0.519841 0.344828 O\n0.166094 0.332131 0.591484 O\n0.000035 0.000028 0.805337 O\n-0.000035 -0.000007 0.305337 O\n0.333287 0.666658 0.111582 O\n0.960342 0.480183 0.844828 O\n0.166104 0.833991 0.591484 O\n0.480151 0.960352 0.344808 O\n0.833906 0.166036 0.091483 O\n",
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{
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{
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}