Structure 2108698

2108697 << 2108698 >> 2108699
Original COD entry Download CIF Download DOT

Citation: Lindenthal, Lorenz; Ruh, Thomas; Rameshan, Raffael; Summerer, Harald; Nenning, Andreas; Herzig, Christopher; L\"offler, Stefan; Limbeck, Andreas; Opitz, Alexander Karl; Blaha, Peter; Rameshan, Christoph (2020). Ca-doped rare earth perovskite materials for tailored exsolution of metal nanoparticles. Acta Crystallographica Section B, 76, pp. -.

Formula: Ca0.12 Fe Nd0.88 O3

Chemical name: Neodymium calcium iron oxide

Cell parameters:

  • a = 7.793071 Å
  • b = 7.757502 Å
  • c = 7.793071 Å
  • α = 90.000000°
  • β = 88.786474°
  • γ = 90.000000°

List type: noninterleaving

List: 3D

Combined 3D structure and graph

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JSmol combined CIF view

Linear Graph Knot

Molecules

CIF datablock 0, entity 1 of 1

Basis: (1;0;0 0;1;0 0;0;1)

Dimensionality: 3

Formula: Fe8 Nd7 O24 (Fe8 Nd7 O24)

Multiplicity: 1

Coordination sequences:

  • 3, 26, 93, 204, 383, 617, 904, 1252, 1673, 2078
  • 3, 28, 97, 226, 399, 633, 917, 1276, 1643, 2095
  • 4, 35, 106, 243, 413, 677, 941, 1310, 1700, 2168
  • 4, 36, 104, 224, 422, 634, 916, 1293, 1684, 2119
  • 4, 36, 105, 242, 424, 663, 953, 1347, 1690, 2182
  • 4, 36, 106, 242, 433, 674, 980, 1317, 1714, 2182
  • 4, 36, 108, 240, 429, 678, 965, 1326, 1749, 2166
  • 4, 36, 114, 234, 425, 666, 967, 1287, 1744, 2147
  • 4, 37, 117, 251, 428, 694, 954, 1337, 1694, 2211
  • 4, 38, 114, 238, 430, 674, 964, 1304, 1750, 2159
  • 4, 38, 120, 241, 433, 684, 972, 1332, 1748, 2183
  • 5, 42, 111, 244, 434, 700, 977, 1350, 1750, 2224
  • 5, 43, 115, 248, 450, 665, 991, 1340, 1740, 2167
  • 5, 43, 118, 256, 445, 680, 994, 1345, 1757, 2198
  • 5, 44, 120, 251, 430, 682, 977, 1327, 1730, 2228
  • 5, 45, 128, 262, 461, 697, 1005, 1352, 1766, 2211
  • 11, 53, 136, 292, 503, 737, 1064, 1462, 1818, 2312
  • 11, 55, 146, 306, 510, 754, 1075, 1475, 1856, 2367
  • 11, 56, 148, 297, 497, 783, 1062, 1461, 1871, 2358
  • 12, 63, 159, 315, 534, 808, 1112, 1486, 1945, 2362
  • 16, 54, 158, 320, 543, 794, 1144, 1474, 1951, 2382
  • 17, 63, 163, 318, 530, 807, 1133, 1531, 1921, 2424
  • 18, 66, 154, 322, 501, 796, 1084, 1516, 1876, 2452
  • 18, 68, 164, 322, 545, 814, 1126, 1484, 1981, 2393
  • 18, 68, 170, 332, 522, 800, 1154, 1527, 1921, 2445
  • 18, 70, 182, 337, 549, 799, 1143, 1498, 1928, 2392
  • 19, 74, 180, 341, 570, 796, 1187, 1476, 1965, 2415
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