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{
"id": "jvasp-10258",
"created_at": "2022-09-04T14:38:10.344618Z",
"updated_at": "2022-09-04T14:38:10.344645Z",
"structure_string": "Rb4 Ag4 O4\n1.0\n5.372242 -0.000000 2.181474\n2.686121 7.111692 1.090738\n0.010495 -0.000000 7.679909\nRb Ag O\n4 4 4\ndirect\n0.937032 0.812967 0.812967 Rb\n0.250000 0.812967 0.187033 Rb\n0.249999 0.187033 0.812967 Rb\n0.562967 0.187033 0.187033 Rb\n0.896293 0.500000 0.207413 Ag\n0.896293 0.207413 0.500000 Ag\n0.603706 0.792587 0.500000 Ag\n0.603706 0.500000 0.792587 Ag\n0.460222 0.789778 0.789778 O\n0.749999 0.789778 0.210222 O\n0.749999 0.210222 0.789778 O\n0.039778 0.210222 0.210222 O\n",
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{
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"structure_string": "Rb2 Ag2 O4\n1.0\n1.585116 4.144047 -0.000000\n-0.000000 0.000000 6.008653\n6.657383 -0.171298 -0.000000\nRb Ag O\n2 2 4\ndirect\n0.294735 0.250000 0.410532 Rb\n0.705266 0.750000 0.589468 Rb\n0.003034 0.250000 0.993930 Ag\n0.996966 0.750000 0.006070 Ag\n0.107316 0.994202 0.785367 O\n0.892684 0.005798 0.214633 O\n0.892684 0.494202 0.214633 O\n0.107316 0.505797 0.785367 O\n",
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{
"id": "jvasp-36846",
"created_at": "2022-09-04T14:38:02.880052Z",
"updated_at": "2022-09-04T14:38:02.880076Z",
"structure_string": "Rb2 Ag2 O4\n1.0\n4.306845 3.422457 1.550727\n0.007597 0.036772 -5.715371\n-4.577183 3.469701 1.091525\nRb Ag O\n2 2 4\ndirect\n0.646310 0.353690 0.250000 Rb\n0.353691 0.646310 0.749999 Rb\n0.000000 0.000000 0.000000 Ag\n0.000000 0.000000 0.500000 Ag\n0.150685 0.249718 0.322036 O\n0.249718 0.150685 0.822036 O\n0.849316 0.750283 0.677962 O\n0.750283 0.849315 0.177963 O\n",
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"volume": 175.38630993965788,
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"formula_full": "Rb2 Ag2 O4",
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"formula_anonymous": "ABC2",
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"spacegroup": 15
},
{
"id": "jvasp-36245",
"created_at": "2022-09-04T14:37:20.107577Z",
"updated_at": "2022-09-04T14:37:20.107614Z",
"structure_string": "Rb1 Ag1 O1\n1.0\n3.150316 3.150316 0.000000\n3.150316 -0.000000 -3.150316\n-0.000000 3.150316 -3.150316\nRb Ag O\n1 1 1\ndirect\n0.500001 0.500001 0.500001 Rb\n0.000000 0.000000 0.000000 Ag\n0.750001 0.750001 0.750001 O\n",
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"volume": 62.53056494734151,
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"formula_full": "Rb1 Ag1 O1",
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},
{
"id": "jvasp-36832",
"created_at": "2022-09-04T14:38:04.524797Z",
"updated_at": "2022-09-04T14:38:04.524819Z",
"structure_string": "Rb1 Ag1 O2\n1.0\n3.077055 -0.000000 0.000000\n0.000000 3.763280 0.000000\n0.000000 0.000000 6.022821\nRb Ag O\n1 1 2\ndirect\n0.500001 0.500000 0.500000 Rb\n0.500001 0.000000 0.000000 Ag\n0.000000 0.000000 0.220824 O\n0.000000 0.000000 0.779176 O\n",
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"elements": [
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"volume": 69.74318030413149,
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"formula_full": "Rb1 Ag1 O2",
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},
{
"id": "jvasp-21506",
"created_at": "2022-09-04T14:38:19.154786Z",
"updated_at": "2022-09-04T14:38:19.154812Z",
"structure_string": "Rb2 Ag2 F6\n1.0\n5.413551 -0.151587 -3.001905\n-3.500161 5.104451 -0.185471\n-0.103945 0.151587 6.189278\nRb Ag F\n2 2 6\ndirect\n0.000000 0.250000 0.250000 Rb\n0.000001 0.750000 0.750001 Rb\n0.500000 0.500000 0.000000 Ag\n0.500000 -0.000000 0.500001 Ag\n0.000977 0.250488 0.750488 F\n0.500001 0.750488 0.749513 F\n0.500000 0.249512 0.250488 F\n0.999023 0.749512 0.249513 F\n0.500000 0.750000 0.250001 F\n0.500001 0.250000 0.750001 F\n",
"nsites": 10,
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"elements": [
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"density": 4.951723953832207,
"density_atomic": 0.059561048565608884,
"volume": 167.8949622417174,
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"formula_full": "Rb2 Ag2 F6",
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{
"id": "jvasp-36895",
"created_at": "2022-09-04T14:37:16.080609Z",
"updated_at": "2022-09-04T14:37:16.080629Z",
"structure_string": "Rb1 Ag1 Cl3\n1.0\n5.088529 -0.002154 -0.001077\n0.001792 5.088642 -0.003277\n0.000875 0.002347 5.088713\nRb Ag Cl\n1 1 3\ndirect\n0.999999 0.998036 0.011850 Rb\n0.500005 0.497987 0.512046 Ag\n-0.000003 0.498074 0.511998 Cl\n0.500042 0.497912 0.012046 Cl\n0.499959 0.997994 0.512054 Cl\n",
"nsites": 5,
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"elements": [
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],
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"density": 3.7768198989154356,
"density_atomic": 0.03794614702330327,
"volume": 131.76568353380986,
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"formula_full": "Rb1 Ag1 Cl3",
"formula_reduced": "RbAgCl3",
"formula_anonymous": "ABC3",
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"spacegroup": 221
},
{
"id": "jvasp-59034",
"created_at": "2022-09-04T14:38:17.244682Z",
"updated_at": "2022-09-04T14:38:17.244703Z",
"structure_string": "Rb8 Ag4 Cl12\n1.0\n4.452711 -0.000000 0.000000\n0.000000 9.151371 0.000000\n0.000000 0.000000 17.763187\nRb Ag Cl\n8 4 12\ndirect\n0.250000 0.928555 0.712618 Rb\n0.750000 0.071445 0.287382 Rb\n0.250000 0.428555 0.787382 Rb\n0.750000 0.571445 0.212618 Rb\n0.750000 0.243569 0.541532 Rb\n0.250000 0.756430 0.458469 Rb\n0.750000 0.743569 0.958469 Rb\n0.250000 0.256430 0.041531 Rb\n0.750000 0.125532 0.867021 Ag\n0.250000 0.874468 0.132980 Ag\n0.750000 0.625532 0.632980 Ag\n0.250000 0.374468 0.367021 Ag\n0.250000 0.993660 0.902262 Cl\n0.750000 0.884039 0.573029 Cl\n0.250000 0.115961 0.426971 Cl\n0.750000 0.384039 0.926971 Cl\n0.250000 0.615961 0.073029 Cl\n0.750000 0.692714 0.775588 Cl\n0.250000 0.307286 0.224412 Cl\n0.750000 0.192714 0.724412 Cl\n0.250000 0.807286 0.275588 Cl\n0.250000 0.493660 0.597739 Cl\n0.750000 0.506340 0.402262 Cl\n0.750000 0.006340 0.097738 Cl\n",
"nsites": 24,
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"elements": [
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],
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"volume": 723.82163240971,
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"formula_full": "Rb8 Ag4 Cl12",
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"formula_anonymous": "AB2C3",
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},
{
"id": "jvasp-36896",
"created_at": "2022-09-04T14:38:01.691651Z",
"updated_at": "2022-09-04T14:38:01.691671Z",
"structure_string": "Rb1 Ag1 Br3\n1.0\n5.365890 0.004202 0.000114\n-0.004284 5.366010 0.007578\n-0.000139 -0.007727 5.365965\nRb Ag Br\n1 1 3\ndirect\n-0.000003 0.011788 0.001865 Rb\n0.500011 0.512080 0.502066 Ag\n0.000001 0.512006 0.501910 Br\n0.500040 0.012076 0.502110 Br\n0.499949 0.512048 0.002045 Br\n",
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],
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{
"id": "jvasp-42057",
"created_at": "2022-09-04T14:37:42.306344Z",
"updated_at": "2022-09-04T14:37:42.306364Z",
"structure_string": "Rb1 Ac1 Te2\n1.0\n-0.000000 4.140498 4.140498\n4.140498 0.000000 4.140498\n4.140498 4.140498 -0.000000\nRb Ac Te\n1 1 2\ndirect\n0.749999 0.749999 0.749999 Rb\n0.249999 0.249999 0.249999 Ac\n0.000000 0.000000 0.000000 Te\n0.500000 0.500000 0.500000 Te\n",
"nsites": 4,
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},
{
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"created_at": "2022-09-04T14:37:53.510324Z",
"updated_at": "2022-09-04T14:37:53.510342Z",
"structure_string": "Rb1 Ac1 O3\n1.0\n4.633998 -0.000000 -0.000000\n0.000000 4.633998 -0.000000\n0.000000 0.000000 4.633998\nRb Ac O\n1 1 3\ndirect\n0.000000 0.000000 0.000000 Rb\n0.500000 0.500000 0.500000 Ac\n0.500000 0.500000 0.000000 O\n0.500000 0.000000 0.500000 O\n0.000000 0.500000 0.500000 O\n",
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},
{
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"structure_string": "Pu1 Zr4 C5\n1.0\n3.339541 0.002780 13.577898\n1.647604 2.904814 13.577898\n0.004768 0.002780 13.982554\nPu Zr C\n1 4 5\ndirect\n0.000000 0.000000 0.000000 Pu\n0.596828 0.596827 0.596829 Zr\n0.198960 0.198959 0.198960 Zr\n0.801040 0.801039 0.801041 Zr\n0.403172 0.403171 0.403173 Zr\n0.701771 0.701771 0.701773 C\n0.500000 0.499999 0.500001 C\n0.101030 0.101030 0.101030 C\n0.298228 0.298228 0.298229 C\n0.898970 0.898969 0.898972 C\n",
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