Structures by: Blaha P.

Total: 10

Calcium Pentafluoroaluminate

AlCaF5

Body, M.Silly, G.Legein, C.Buzaré, J.-Y.Calvayrac, F.Blaha, P.

Journal of Solid State Chemistry (2005) 178, 12 3655-3643

a=5.3361(1)Å   b=9.8298(2)Å   c=7.3271(1)Å

α=90.000°   β=109.911(1)°   γ=90.000°

Neodymium calcium ferrite

Ca0.1FeNd0.9O3

Lindenthal, LorenzRuh, ThomasRameshan, RaffaelSummerer, HaraldNenning, AndreasHerzig, ChristopherLöffler, StefanLimbeck, AndreasOpitz, Alexander KarlBlaha, PeterRameshan, Christoph

Acta Crystallographica Section B (2020) 76, 6

a=5.568011Å   b=7.756535Å   c=5.451495Å

α=90°   β=90°   γ=90°

Lanthanum calcium ferrite

Ca0.12FeLa0.88O3

Lindenthal, LorenzRuh, ThomasRameshan, RaffaelSummerer, HaraldNenning, AndreasHerzig, ChristopherLöffler, StefanLimbeck, AndreasOpitz, Alexander KarlBlaha, PeterRameshan, Christoph

Acta Crystallographica Section B (2020) 76, 6

a=7.860187Å   b=7.839117Å   c=7.860187Å

α=90.000000°   β=89.747645°   γ=90.000000°

Lanthanum calcium ferrite

Ca0.5FeLa0.5O3

Lindenthal, LorenzRuh, ThomasRameshan, RaffaelSummerer, HaraldNenning, AndreasHerzig, ChristopherLöffler, StefanLimbeck, AndreasOpitz, Alexander KarlBlaha, PeterRameshan, Christoph

Acta Crystallographica Section B (2020) 76, 6

a=5.570218Å   b=7.839117Å   c=5.545738Å

α=90.000000°   β=90.000000°   γ=90.000000°

Neodymium calcium ferrite

Ca0.5FeNd0.5O3

Lindenthal, LorenzRuh, ThomasRameshan, RaffaelSummerer, HaraldNenning, AndreasHerzig, ChristopherLöffler, StefanLimbeck, AndreasOpitz, Alexander KarlBlaha, PeterRameshan, Christoph

Acta Crystallographica Section B (2020) 76, 6

a=5.568580Å   b=7.757502Å   c=5.451869Å

α=90.000000°   β=90.000000°   γ=90.000000°

Neodymium calcium ferrite

Ca0.12FeNd0.88O3

Lindenthal, LorenzRuh, ThomasRameshan, RaffaelSummerer, HaraldNenning, AndreasHerzig, ChristopherLöffler, StefanLimbeck, AndreasOpitz, Alexander KarlBlaha, PeterRameshan, Christoph

Acta Crystallographica Section B (2020) 76, 6

a=7.793071Å   b=7.757502Å   c=7.793071Å

α=90.000000°   β=88.786474°   γ=90.000000°

Lanthanum calcium ferrite

Ca0.4FeLa0.6O3

Lindenthal, LorenzRuh, ThomasRameshan, RaffaelSummerer, HaraldNenning, AndreasHerzig, ChristopherLöffler, StefanLimbeck, AndreasOpitz, Alexander KarlBlaha, PeterRameshan, Christoph

Acta Crystallographica Section B (2020) 76, 6

a=5.506428Å   b=7.776180Å   c=5.529845Å

α=90°   β=90°   γ=90°

Lanthanum calcium ferrite

Ca0.1FeLa0.9O3

Lindenthal, LorenzRuh, ThomasRameshan, RaffaelSummerer, HaraldNenning, AndreasHerzig, ChristopherLöffler, StefanLimbeck, AndreasOpitz, Alexander KarlBlaha, PeterRameshan, Christoph

Acta Crystallographica Section B (2020) 76, 6

a=5.558528Å   b=7.837216Å   c=5.547272Å

α=90°   β=90°   γ=90°

O12Si5Tl4

O12Si5Tl4

Volker KahlenbergLukas PerflerJürgen KonzettPeter Blaha

Inorganic Chemistry (2013) 52, 8941-8949

a=9.2059(5)Å   b=11.5796(6)Å   c=13.0963(7)Å

α=90°   β=94.534(5)°   γ=90°

Forsterite

Mg2O4Si

Kirfel, A.Lippmann, T.Blaha, P.Schwarz, K.Cox, D. F.Rosso, K. M.Gibbs, G. V.

Physics and Chemistry of Minerals (2005) 32, 301-313

a=4.752Å   b=10.192Å   c=5.978Å

α=90°   β=90°   γ=90°