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"structure_string": "Na4 Ag4 O4\n1.0\n-4.817204 4.817204 2.343031\n4.817204 -4.817204 2.343031\n4.817204 4.817204 -2.343031\nNa Ag O\n4 4 4\ndirect\n0.753068 0.913334 0.160266 Na\n0.753068 0.592802 0.839734 Na\n0.086666 0.246932 0.839734 Na\n0.407198 0.246932 0.160266 Na\n0.406107 0.593893 0.500000 Ag\n0.093893 0.906107 0.500000 Ag\n0.406107 0.906107 0.812215 Ag\n0.093893 0.593893 0.187785 Ag\n0.254146 0.062912 0.808766 O\n0.254146 0.445380 0.191234 O\n0.937088 0.745854 0.191234 O\n0.554620 0.745854 0.808766 O\n",
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"formula_full": "Na4 Ag4 O4",
"formula_reduced": "NaAgO",
"formula_anonymous": "ABC",
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"updated_at": "2021-11-28T01:37:56.623000Z",
"spacegroup": 119
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{
"id": "mp-697645",
"created_at": "2022-09-04T14:45:17.577121Z",
"structure_string": "H26 Se4 N6 O16\n1.0\n3.099222 5.304246 0.000000\n-3.099222 5.304246 0.000000\n0.000000 4.162441 15.531065\nH Se N O\n26 4 6 16\ndirect\n0.747971 0.223378 0.247660 H\n0.223378 0.747971 0.747660 H\n0.748692 0.400226 0.699810 H\n0.400226 0.748692 0.199810 H\n0.862445 0.259944 0.796126 H\n0.259944 0.862445 0.296126 H\n0.865329 0.083991 0.726336 H\n0.083991 0.865329 0.226336 H\n0.594651 0.276548 0.780971 H\n0.276548 0.594651 0.280971 H\n0.195495 0.773726 0.559602 H\n0.773726 0.195495 0.059602 H\n0.208868 0.619358 0.481649 H\n0.619358 0.208868 0.981649 H\n0.998820 0.640566 0.571209 H\n0.640566 0.998820 0.071209 H\n0.313951 0.451074 0.575159 H\n0.451074 0.313951 0.075159 H\n0.826172 0.212898 0.466998 H\n0.212898 0.826172 0.966998 H\n0.027198 0.341810 0.430951 H\n0.341810 0.027198 0.930951 H\n0.774668 0.473855 0.506427 H\n0.473855 0.774668 0.006427 H\n0.729396 0.495521 0.405230 H\n0.495521 0.729396 0.905230 H\n0.554367 0.057759 0.366095 Se\n0.057759 0.554367 0.866095 Se\n0.467321 0.922064 0.634251 Se\n0.922064 0.467321 0.134251 Se\n0.770221 0.253649 0.750510 N\n0.253649 0.770221 0.250510 N\n0.179559 0.621414 0.546815 N\n0.621414 0.179559 0.046815 N\n0.839691 0.378935 0.452960 N\n0.378935 0.839691 0.952960 N\n0.438346 0.857320 0.378792 O\n0.857320 0.438346 0.878792 O\n0.660064 0.098099 0.255742 O\n0.098099 0.660064 0.755742 O\n0.803763 0.950266 0.415881 O\n0.950266 0.803763 0.915881 O\n0.326638 0.342317 0.388639 O\n0.342317 0.326638 0.888639 O\n0.565015 0.138132 0.619667 O\n0.138132 0.565015 0.119667 O\n0.370982 0.863071 0.740710 O\n0.863071 0.370982 0.240710 O\n0.703968 0.642227 0.605333 O\n0.642227 0.703968 0.105333 O\n0.223546 0.018115 0.581476 O\n0.018115 0.223546 0.081476 O\n",
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],
"chemical_system": "H-N-O-Se",
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"density_atomic": 0.1018346949715074,
"volume": 510.6314700952285,
"volume_molar": 5.913643441152303,
"formula_full": "H26 Se4 N6 O16",
"formula_reduced": "H13Se2N3O8",
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"updated_at": "2021-11-28T01:36:58.777000Z",
"spacegroup": 9
},
{
"id": "mp-569006",
"created_at": "2022-09-04T14:39:29.462945Z",
"structure_string": "Sr1 As2 Rh2\n1.0\n-2.054176 2.054176 6.011974\n2.054176 -2.054176 6.011974\n2.054176 2.054176 -6.011974\nSr As Rh\n1 2 2\ndirect\n0.000000 0.000000 0.000000 Sr\n0.365043 0.365043 0.000000 As\n0.634957 0.634957 0.000000 As\n0.250000 0.750000 0.500000 Rh\n0.750000 0.250000 0.500000 Rh\n",
"nsites": 5,
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"elements": [
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],
"chemical_system": "As-Rh-Sr",
"density": 7.253859933726003,
"density_atomic": 0.04927397713347453,
"volume": 101.4734407668348,
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"formula_full": "Sr1 As2 Rh2",
"formula_reduced": "Sr(AsRh)2",
"formula_anonymous": "AB2C2",
"energy": -29.70472025,
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"updated_at": "2021-11-28T01:34:29.737000Z",
"spacegroup": 139
},
{
"id": "mp-1201",
"created_at": "2022-09-04T14:41:16.390597Z",
"structure_string": "Sb2 Te3\n1.0\n10.524230 -2.166418 0.000000\n10.524230 2.166418 0.000000\n10.078272 0.000000 3.725752\nSb Te\n2 3\ndirect\n0.603278 0.603278 0.603278 Sb\n0.396722 0.396722 0.396722 Sb\n0.784625 0.784625 0.784625 Te\n0.215375 0.215375 0.215375 Te\n0.000000 0.000000 0.000000 Te\n",
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],
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"density": 6.121655030547824,
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"volume": 169.89340676713044,
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"formula_full": "Sb2 Te3",
"formula_reduced": "Sb2Te3",
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"updated_at": "2021-11-28T01:35:18.480000Z",
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}
]
}