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{
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{
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},
{
"id": "mp-1224021",
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{
"id": "mp-1201881",
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{
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"created_at": "2022-09-04T14:43:50.400881Z",
"structure_string": "Y1 Bi1 Pt1\n1.0\n0.000000 3.377123 3.377123\n3.377123 0.000000 3.377123\n3.377123 3.377123 0.000000\nY Bi Pt\n1 1 1\ndirect\n0.500000 0.500000 0.500000 Y\n0.000000 0.000000 0.000000 Bi\n0.250000 0.250000 0.250000 Pt\n",
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{
"id": "mp-1019728",
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"structure_string": "Rb4 Eu4 P16 O48\n1.0\n9.150816 0.000000 0.000000\n0.000000 10.659663 0.000000\n0.000000 7.436155 10.718962\nRb Eu P O\n4 4 16 48\ndirect\n0.434271 0.757900 0.041450 Rb\n0.065729 0.757900 0.541450 Rb\n0.565729 0.242100 0.958550 Rb\n0.934271 0.242100 0.458550 Rb\n0.726255 0.683925 0.315851 Eu\n0.773745 0.683925 0.815851 Eu\n0.273745 0.316075 0.684149 Eu\n0.226255 0.316075 0.184149 Eu\n0.327074 0.679748 0.360339 P\n0.172926 0.679748 0.860339 P\n0.672926 0.320252 0.639661 P\n0.827074 0.320252 0.139661 P\n0.528419 0.027231 0.723620 P\n0.971581 0.027231 0.223620 P\n0.471581 0.972769 0.276380 P\n0.028419 0.972769 0.776380 P\n0.896759 0.800962 0.021659 P\n0.603241 0.800962 0.521659 P\n0.103241 0.199038 0.978341 P\n0.396759 0.199038 0.478341 P\n0.094091 0.615518 0.240400 P\n0.405909 0.615518 0.740400 P\n0.905909 0.384482 0.759600 P\n0.594091 0.384482 0.259600 P\n0.595109 0.871320 0.802729 O\n0.904891 0.871320 0.302729 O\n0.404891 0.128680 0.197271 O\n0.095109 0.128680 0.697271 O\n0.458676 0.043431 0.601636 O\n0.041324 0.043431 0.101636 O\n0.541324 0.956569 0.398364 O\n0.958676 0.956569 0.898364 O\n0.418102 0.068520 0.785495 O\n0.081898 0.068520 0.285495 O\n0.581898 0.931480 0.214505 O\n0.918102 0.931480 0.714505 O\n0.466352 0.638040 0.325806 O\n0.033648 0.638040 0.825806 O\n0.533648 0.361960 0.674194 O\n0.966352 0.361960 0.174194 O\n0.658250 0.699149 0.484960 O\n0.841750 0.699149 0.984960 O\n0.341750 0.300851 0.515040 O\n0.158250 0.300851 0.015040 O\n0.793141 0.837032 0.090880 O\n0.706859 0.837032 0.590880 O\n0.206859 0.162968 0.909120 O\n0.293141 0.162968 0.409120 O\n0.741211 0.423722 0.513871 O\n0.758789 0.423722 0.013871 O\n0.258789 0.576278 0.486129 O\n0.241211 0.576278 0.986129 O\n0.208118 0.724212 0.251460 O\n0.291882 0.724212 0.751460 O\n0.791882 0.275788 0.748540 O\n0.708118 0.275788 0.248540 O\n0.050295 0.736159 0.096193 O\n0.449705 0.736159 0.596193 O\n0.949705 0.263841 0.903807 O\n0.550295 0.263841 0.403807 O\n0.676675 0.514209 0.246393 O\n0.823325 0.514209 0.746393 O\n0.323325 0.485791 0.753607 O\n0.176675 0.485791 0.253607 O\n0.964436 0.578600 0.323635 O\n0.535564 0.578600 0.823635 O\n0.035564 0.421400 0.676365 O\n0.464436 0.421400 0.176365 O\n0.658572 0.153811 0.662956 O\n0.841428 0.153811 0.162956 O\n0.341428 0.846189 0.337044 O\n0.158572 0.846189 0.837044 O\n",
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{
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{
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{
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{
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"density_atomic": 0.04874069030383512,
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"volume_molar": 12.355468752001146,
"formula_full": "Sm1 Ag2 Ge2",
"formula_reduced": "Sm(AgGe)2",
"formula_anonymous": "AB2C2",
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"band_gap": 0.0,
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"updated_at": "2021-11-28T01:36:23.781000Z",
"spacegroup": 139
},
{
"id": "mp-568565",
"created_at": "2022-09-04T14:43:50.458154Z",
"structure_string": "Cr2 As2\n1.0\n1.821690 -3.155259 0.000000\n1.821690 3.155259 0.000000\n0.000000 0.000000 5.633955\nCr As\n2 2\ndirect\n0.000000 0.000000 0.000000 Cr\n0.000000 0.000000 0.500000 Cr\n0.333333 0.666667 0.250000 As\n0.666667 0.333333 0.750000 As\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Cr",
"As"
],
"chemical_system": "As-Cr",
"density": 6.508013248385811,
"density_atomic": 0.06175997810119183,
"volume": 64.7668623432172,
"volume_molar": 9.750879040359935,
"formula_full": "Cr2 As2",
"formula_reduced": "CrAs",
"formula_anonymous": "AB",
"energy": -29.33510661,
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"updated_at": "2021-11-28T01:36:19.874000Z",
"spacegroup": 194
}
]
}