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{
"id": "jvasp-75030",
"created_at": "2022-09-04T14:35:52.447525Z",
"updated_at": "2022-09-04T14:35:52.447547Z",
"structure_string": "Hf1 Be1 Ga1\n1.0\n1.469016 -2.544411 0.000000\n1.469016 2.544411 -0.000000\n0.000000 0.000000 6.605207\nHf Be Ga\n1 1 1\ndirect\n0.333335 0.666668 0.678261 Hf\n0.000000 -0.000000 0.018146 Be\n0.666668 0.333335 0.303593 Ga\n",
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{
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"structure_string": "Hf2 Be1 Ga1\n1.0\n3.028142 0.000000 0.000000\n0.000000 3.028142 0.000000\n-0.000000 0.000000 7.417089\nHf Be Ga\n2 1 1\ndirect\n0.000000 0.000000 0.978301 Hf\n0.500000 0.500000 0.287587 Hf\n0.000000 0.000000 0.534067 Be\n0.500000 0.500000 0.700045 Ga\n",
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{
"id": "jvasp-67803",
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"structure_string": "Hf1 Be1 Ga1\n1.0\n-1.485378 1.485378 5.165700\n1.485378 -1.485378 5.165700\n1.485378 1.485378 -5.165700\nHf Be Ga\n1 1 1\ndirect\n0.656528 0.656528 0.000000 Hf\n0.985214 0.985214 0.000000 Be\n0.358258 0.358258 0.000000 Ga\n",
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{
"id": "jvasp-65095",
"created_at": "2022-09-04T14:35:41.407009Z",
"updated_at": "2022-09-04T14:35:41.407030Z",
"structure_string": "Hf1 Be1 Ga4\n1.0\n0.000000 3.691273 3.691273\n3.691273 0.000000 3.691273\n3.691273 3.691273 0.000000\nHf Be Ga\n1 1 4\ndirect\n0.250000 0.250000 0.250000 Hf\n0.000000 0.000000 0.000000 Be\n0.123628 0.625456 0.625456 Ga\n0.625456 0.625456 0.625456 Ga\n0.625456 0.123628 0.625456 Ga\n0.625456 0.625456 0.123628 Ga\n",
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"formula_full": "Hf1 Be1 Ga4",
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"formula_anonymous": "ABC4",
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"spacegroup": 216
},
{
"id": "jvasp-68875",
"created_at": "2022-09-04T14:35:40.907690Z",
"updated_at": "2022-09-04T14:35:40.907731Z",
"structure_string": "Be1 Ga1 Ge1\n1.0\n1.588520 -2.751396 -0.000000\n1.588520 2.751396 0.000000\n0.000000 -0.000000 5.407184\nBe Ga Ge\n1 1 1\ndirect\n-0.000000 0.000000 0.996498 Be\n0.666667 0.333333 0.305809 Ga\n0.333333 0.666667 0.697691 Ge\n",
"nsites": 3,
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"formula_full": "Be1 Ga1 Ge1",
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},
{
"id": "jvasp-74819",
"created_at": "2022-09-04T14:36:15.371961Z",
"updated_at": "2022-09-04T14:36:15.371989Z",
"structure_string": "Be2 Ga1 Ge1\n1.0\n2.726891 0.000000 0.000000\n0.000000 2.726891 0.000000\n-0.000000 0.000000 7.202876\nBe Ga Ge\n2 1 1\ndirect\n0.000000 0.000000 0.259161 Be\n0.000000 0.000000 0.740840 Be\n0.500000 0.500000 0.500000 Ga\n0.500000 0.500000 0.000000 Ge\n",
"nsites": 4,
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{
"id": "jvasp-122647",
"created_at": "2022-09-04T14:38:54.074329Z",
"updated_at": "2022-09-04T14:38:54.074365Z",
"structure_string": "Be1 Ga3\n1.0\n4.285644 -0.222985 0.017238\n-2.269553 3.642196 -0.017238\n0.017386 -0.010251 4.483189\nBe Ga\n1 3\ndirect\n0.188066 0.811938 0.918244 Be\n0.313420 0.686582 0.410714 Ga\n0.885181 0.114821 0.028566 Ga\n0.613338 0.386665 0.642477 Ga\n",
"nsites": 4,
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"volume": 67.70857735565215,
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{
"id": "jvasp-95719",
"created_at": "2022-09-04T14:36:11.914112Z",
"updated_at": "2022-09-04T14:36:11.914135Z",
"structure_string": "Yb4 Be4 F16\n1.0\n7.589809 0.972652 -0.614353\n-1.299205 6.676816 -0.669818\n-0.397810 -0.592786 5.486454\nYb Be F\n4 4 16\ndirect\n0.822146 0.853145 0.774501 Yb\n0.364347 0.946621 0.711714 Yb\n0.177855 0.146854 0.225500 Yb\n0.635653 0.053378 0.288287 Yb\n0.816180 0.533064 0.241370 Be\n0.183821 0.466938 0.758629 Be\n0.805155 0.384264 0.710927 Be\n0.194846 0.615737 0.289071 Be\n0.435434 0.174519 0.509042 F\n0.849608 0.754717 0.354898 F\n0.581604 0.831477 0.948035 F\n0.274066 0.527499 0.047624 F\n0.116368 0.917721 0.866037 F\n0.150395 0.245283 0.645104 F\n0.810100 0.158505 0.674939 F\n0.883633 0.082276 0.133964 F\n-0.018346 0.536349 0.759798 F\n0.018347 0.463650 0.240197 F\n0.418396 0.168521 0.051966 F\n0.564567 0.825479 0.490959 F\n0.273841 0.581682 0.572212 F\n0.189899 0.841496 0.325064 F\n0.725935 0.472507 0.952374 F\n0.726160 0.418317 0.427783 F\n",
"nsites": 24,
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],
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"density": 6.119087179381374,
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{
"id": "jvasp-22440",
"created_at": "2022-09-04T14:37:49.735078Z",
"updated_at": "2022-09-04T14:37:49.735097Z",
"structure_string": "Sr4 Be4 F16\n1.0\n0.000000 5.383236 0.025358\n8.236757 0.000000 0.000000\n0.000000 -5.218972 -6.854755\nSr Be F\n4 4 16\ndirect\n0.031446 0.308031 0.331052 Sr\n0.968555 0.808031 0.168948 Sr\n0.968555 0.691969 0.668948 Sr\n0.031447 0.191969 0.831053 Sr\n0.431377 0.953590 0.683628 Be\n0.568625 0.453590 0.816373 Be\n0.568625 0.046410 0.316373 Be\n0.431376 0.546411 0.183628 Be\n0.299625 0.542718 0.303760 F\n0.700376 0.042718 0.196240 F\n0.760672 0.317421 0.970913 F\n0.239330 0.817421 0.529088 F\n0.239330 0.682579 0.029087 F\n0.760671 0.182579 0.470913 F\n0.410357 0.123469 0.597951 F\n0.208163 0.411965 0.678512 F\n0.589644 0.876531 0.402050 F\n0.410357 0.376531 0.097950 F\n0.299625 0.957283 0.803760 F\n0.791839 0.911965 0.821489 F\n0.791838 0.588035 0.321489 F\n0.208163 0.088035 0.178511 F\n0.589645 0.623470 0.902050 F\n0.700377 0.457282 0.696241 F\n",
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"volume": 302.85255065854494,
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"formula_full": "Sr4 Be4 F16",
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},
{
"id": "jvasp-98231",
"created_at": "2022-09-04T14:37:51.597357Z",
"updated_at": "2022-09-04T14:37:51.597393Z",
"structure_string": "Sm4 Be4 F16\n1.0\n5.272448 0.000000 0.000000\n0.000000 6.774663 0.000000\n0.000000 0.000000 8.246358\nSm Be F\n4 4 16\ndirect\n0.783539 0.899651 0.863221 Sm\n0.283539 0.100348 0.136779 Sm\n0.783539 0.600348 0.363221 Sm\n0.283539 0.399652 0.636779 Sm\n0.283475 0.634230 0.050585 Be\n0.783476 0.365770 0.949415 Be\n0.783476 0.134230 0.449415 Be\n0.283475 0.865769 0.550585 Be\n0.783424 0.942431 0.350685 F\n0.283424 0.057569 0.649315 F\n0.783424 0.557568 0.850685 F\n0.783418 0.410378 0.131882 F\n0.046436 0.730285 0.596665 F\n0.546436 0.269715 0.403335 F\n0.046436 0.769714 0.096665 F\n0.546436 0.230285 0.903335 F\n0.020508 0.269705 0.403365 F\n0.520508 0.730294 0.596636 F\n0.020508 0.230295 0.903365 F\n0.520508 0.769705 0.096636 F\n0.283418 0.910378 0.368118 F\n0.783418 0.089622 0.631882 F\n0.283418 0.589621 0.868118 F\n0.283424 0.442431 0.149315 F\n",
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"volume": 294.55214286580974,
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{
"id": "jvasp-22868",
"created_at": "2022-09-04T14:37:35.752198Z",
"updated_at": "2022-09-04T14:37:35.752208Z",
"structure_string": "Rb2 Be6 Zn2 F18\n1.0\n3.366955 -5.831736 -0.000000\n3.366955 5.831736 -0.000000\n0.000000 0.000000 9.762434\nRb Be Zn F\n2 6 2 18\ndirect\n0.666666 0.333332 0.500000 Rb\n0.666666 0.333332 0.000000 Rb\n0.212377 0.277023 0.750000 Be\n0.212376 0.935353 0.250000 Be\n0.722975 0.787622 0.250000 Be\n0.064646 0.277023 0.250000 Be\n0.064645 0.787622 0.750000 Be\n0.722975 0.935353 0.750000 Be\n0.333332 0.666666 0.000000 Zn\n0.333332 0.666666 0.500000 Zn\n0.084757 0.414407 0.118679 F\n0.585591 0.915242 0.881321 F\n0.084757 0.670349 0.881321 F\n0.084757 0.670349 0.618679 F\n0.585591 0.915242 0.618679 F\n0.329650 0.414407 0.881321 F\n0.242115 0.187001 0.250000 F\n0.944887 0.757884 0.250000 F\n0.329650 0.414407 0.618679 F\n0.812997 0.757884 0.750000 F\n0.944887 0.187001 0.750000 F\n0.242115 0.055112 0.750000 F\n0.585591 0.670349 0.118679 F\n0.329649 0.915242 0.381321 F\n0.585591 0.670349 0.381321 F\n0.084757 0.414407 0.381321 F\n0.812998 0.055111 0.250000 F\n0.329649 0.915242 0.118679 F\n",
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"formula_full": "Rb2 Be6 Zn2 F18",
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{
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"created_at": "2022-09-04T14:38:30.389087Z",
"updated_at": "2022-09-04T14:38:30.389116Z",
"structure_string": "Rb8 Be4 F16\n1.0\n5.862494 0.000000 0.000000\n0.000000 7.692749 0.000000\n0.000000 0.000000 10.226558\nRb Be F\n8 4 16\ndirect\n0.247528 0.484306 0.810161 Rb\n0.747528 0.515694 0.189839 Rb\n0.747528 0.015694 0.310161 Rb\n0.247528 0.984306 0.689839 Rb\n0.247518 0.161649 0.094552 Rb\n0.747518 0.838351 0.905448 Rb\n0.747518 0.338351 0.594552 Rb\n0.247518 0.661649 0.405448 Rb\n0.247551 0.238945 0.418485 Be\n0.747550 0.261055 0.918486 Be\n0.247551 0.738945 0.081515 Be\n0.747550 0.761055 0.581515 Be\n0.747495 0.693037 0.435903 F\n0.247495 0.306963 0.564097 F\n0.247596 0.535481 0.089388 F\n0.747596 0.464519 0.910613 F\n0.747596 0.964519 0.589388 F\n0.247596 0.035481 0.410613 F\n0.966185 0.187233 0.849166 F\n0.528925 0.187277 0.849117 F\n0.466185 0.812767 0.150834 F\n0.466185 0.312767 0.349166 F\n0.028926 0.312723 0.349117 F\n0.528925 0.687277 0.650883 F\n0.747495 0.193037 0.064097 F\n0.028926 0.812723 0.150883 F\n0.966185 0.687233 0.650834 F\n0.247495 0.806963 0.935903 F\n",
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"formula_full": "Rb8 Be4 F16",
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}
]
}