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{
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{
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"structure_string": "Ba1 Ca2 I6\n1.0\n7.977286 -0.000003 -0.000112\n-3.988645 6.908590 0.000072\n-0.000072 0.000012 7.354651\nBa Ca I\n1 2 6\ndirect\n-0.000023 -0.000000 0.999982 Ba\n0.333326 0.666667 0.499996 Ca\n0.666659 0.333334 0.499996 Ca\n-0.000012 0.638680 0.743657 I\n0.000002 0.361306 0.256354 I\n0.361307 0.361320 0.743658 I\n0.638697 0.638694 0.256354 I\n0.361273 -0.000000 0.256364 I\n0.638674 0.000001 0.743638 I\n",
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{
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"created_at": "2022-09-04T14:37:59.133094Z",
"updated_at": "2022-09-04T14:37:59.133125Z",
"structure_string": "Al6 Br24\n1.0\n12.409016 0.000000 -0.000000\n6.204508 10.746522 -0.000000\n6.204508 3.582174 10.131918\nAl Br\n6 24\ndirect\n0.250000 0.250000 0.750000 Al\n0.750001 0.250000 0.750000 Al\n0.750001 0.750000 0.250000 Al\n0.250001 0.749999 0.750000 Al\n0.250000 0.750000 0.250000 Al\n0.750000 0.250000 0.250000 Al\n0.286756 0.067019 0.713245 Br\n0.786756 0.213244 0.567020 Br\n0.786756 0.567019 0.432981 Br\n0.713245 0.286755 0.067020 Br\n0.213245 0.432980 0.567020 Br\n0.432981 0.786755 0.567020 Br\n0.067020 0.713244 0.286755 Br\n0.432981 0.567019 0.213245 Br\n0.567020 0.786755 0.213245 Br\n0.213245 0.567019 0.786756 Br\n0.432981 0.213244 0.786756 Br\n0.713245 0.067019 0.932981 Br\n0.713245 0.932980 0.286755 Br\n0.567020 0.432980 0.786756 Br\n0.786756 0.432980 0.213245 Br\n0.286756 0.713244 0.932981 Br\n0.067020 0.932980 0.713245 Br\n0.286756 0.932980 0.067020 Br\n0.067020 0.286755 0.932981 Br\n0.932981 0.286755 0.713245 Br\n0.932981 0.713244 0.067020 Br\n0.932981 0.067019 0.286755 Br\n0.213245 0.786755 0.432981 Br\n0.567020 0.213244 0.432981 Br\n",
"nsites": 30,
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{
"id": "jvasp-102258",
"created_at": "2022-09-04T14:37:10.049354Z",
"updated_at": "2022-09-04T14:37:10.049378Z",
"structure_string": "K2 Hg1 Sb1 I6\n1.0\n7.451386 -0.000000 4.302060\n2.483795 7.025234 4.302060\n-0.000000 -0.000000 8.604119\nK Hg Sb I\n2 1 1 6\ndirect\n0.750001 0.750000 0.750000 K\n0.250000 0.250000 0.250000 K\n0.500001 0.500000 0.500000 Hg\n0.000000 0.000000 0.000000 Sb\n0.752496 0.247505 0.247505 I\n0.247505 0.247505 0.752495 I\n0.247506 0.752495 0.752495 I\n0.247506 0.752495 0.247505 I\n0.752496 0.247505 0.752495 I\n0.752496 0.752495 0.247505 I\n",
"nsites": 10,
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{
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"created_at": "2022-09-04T14:36:55.115198Z",
"updated_at": "2022-09-04T14:36:55.115223Z",
"structure_string": "Rb2 Tl1 As1 I6\n1.0\n7.451707 0.000000 4.302245\n2.483902 7.025537 4.302245\n-0.000000 -0.000000 8.604490\nRb Tl As I\n2 1 1 6\ndirect\n0.750000 0.750000 0.750001 Rb\n0.250000 0.250000 0.250000 Rb\n0.500000 0.500000 0.500000 Tl\n0.000000 0.000000 0.000000 As\n0.763748 0.236252 0.236252 I\n0.236252 0.236252 0.763748 I\n0.236252 0.763748 0.763749 I\n0.236252 0.763748 0.236252 I\n0.763748 0.236252 0.763748 I\n0.763748 0.763748 0.236253 I\n",
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{
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"created_at": "2022-09-04T14:36:20.901904Z",
"updated_at": "2022-09-04T14:36:20.901932Z",
"structure_string": "Ba4 Y1 Cu1\n1.0\n0.000000 5.132099 5.132099\n5.132099 0.000000 5.132099\n5.132099 5.132099 0.000000\nBa Y Cu\n4 1 1\ndirect\n0.126279 0.624574 0.624574 Ba\n0.624574 0.624574 0.624574 Ba\n0.624574 0.126279 0.624574 Ba\n0.624574 0.624574 0.126279 Ba\n0.000000 0.000000 0.000000 Y\n0.250000 0.250000 0.250000 Cu\n",
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"volume": 270.34296466765034,
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"formula_full": "Ba4 Y1 Cu1",
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{
"id": "jvasp-32828",
"created_at": "2022-09-04T14:38:04.996143Z",
"updated_at": "2022-09-04T14:38:04.996173Z",
"structure_string": "Sn1 I4\n1.0\n6.084812 0.000000 -0.000000\n-0.000000 6.084812 -0.000000\n-0.000000 0.000000 6.084812\nSn I\n1 4\ndirect\n0.000000 0.000000 0.000000 Sn\n0.257923 0.742076 0.742076 I\n0.742076 0.257923 0.742076 I\n0.742076 0.742076 0.257923 I\n0.257923 0.257923 0.257923 I\n",
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},
{
"id": "jvasp-64129",
"created_at": "2022-09-04T14:35:42.097982Z",
"updated_at": "2022-09-04T14:35:42.098000Z",
"structure_string": "K1 Ba1 Zn1\n1.0\n-0.000000 4.073482 4.073482\n4.073482 0.000000 4.073482\n4.073482 4.073482 -0.000000\nK Ba Zn\n1 1 1\ndirect\n0.000000 0.000000 0.000000 K\n0.750000 0.750000 0.750000 Ba\n0.500000 0.500000 0.500000 Zn\n",
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{
"id": "jvasp-64366",
"created_at": "2022-09-04T14:36:19.883579Z",
"updated_at": "2022-09-04T14:36:19.883604Z",
"structure_string": "Ba4 Y1 Sc1\n1.0\n-0.000000 5.132913 5.132913\n5.132913 -0.000000 5.132913\n5.132913 5.132913 -0.000000\nBa Y Sc\n4 1 1\ndirect\n0.125738 0.624753 0.624753 Ba\n0.624753 0.624753 0.624753 Ba\n0.624753 0.125738 0.624753 Ba\n0.624753 0.624753 0.125738 Ba\n0.000000 0.000000 0.000000 Y\n0.250000 0.250000 0.250000 Sc\n",
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{
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"created_at": "2022-09-04T14:36:43.926363Z",
"updated_at": "2022-09-04T14:36:43.926385Z",
"structure_string": "Rb2 Pr1 Ag1 I6\n1.0\n7.454823 -0.000000 4.304044\n2.484941 7.028474 4.304044\n-0.000000 -0.000000 8.608088\nRb Pr Ag I\n2 1 1 6\ndirect\n0.750000 0.750000 0.750000 Rb\n0.250000 0.250000 0.250000 Rb\n0.500000 0.500000 0.500000 Pr\n0.000000 0.000000 0.000000 Ag\n0.754839 0.245161 0.245161 I\n0.245161 0.245161 0.754839 I\n0.245161 0.754839 0.754839 I\n0.245161 0.754839 0.245161 I\n0.754839 0.245161 0.754839 I\n0.754839 0.754839 0.245160 I\n",
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{
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"created_at": "2022-09-04T14:36:11.693989Z",
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"structure_string": "K2 Ba1 Ga1\n1.0\n4.680826 -0.000000 0.000000\n0.000000 4.680826 -0.000000\n-0.000000 -0.000000 8.234892\nK Ba Ga\n2 1 1\ndirect\n0.000000 0.000000 0.697154 K\n0.000000 0.000000 0.302846 K\n0.500000 0.500000 0.000000 Ba\n0.500000 0.500000 0.500000 Ga\n",
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}