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1 article(s) from Oleś, Andrzej M

Ge interfaces

Olga Sikora,
Małgorzata Sternik,
Benedykt R. Jany,
Franciszek Krok,
Przemysław Piekarz and
Andrzej M. Oleś

Beilstein J. Nanotechnol. 2023, 14, 1093–1105, doi:10.3762/bjnano.14.90

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Figure 1: Surfaces of Au and Ge slabs investigated in our study, with experimental interatomic distances: (a)...

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Figure 2: Two variants of Au-fcc(001)/Ge(001) interface atomic arrangement: (a) variant T₁ with the interfaci...

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Figure 3: Convergence tests: (left) dependence of Au-fcc(001) and Ge(001) surface energies on the number of s...

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Figure 4: Surface energies calculated for germanium (left) and Au-fcc right) crystal planes compared to avail...

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Figure 5: The relaxed structures of the simplest coherent interfaces. Two variants of the Au-fcc(001)/Ge(001)...

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Figure 6: Variants A, B, C and D of the Au-fcc(011)/Ge(001) interface (initial configurations) are shown in p...

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Figure 7: Introduction of defects into variant D of the Au-fcc(011)/Ge(001) heterostructure: (a) optimized st...

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Figure 8: Experimentally observed Au-fcc(011)/Ge(001) interface: atomically resolved STEM-HAADF image [23] and at...

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Figure 9: Initial configuration of the Au-hcp(010)/Ge(111) supercell: (a) side view and (b) top view of the i...

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Figure 10: The electron density of states (EDOS) for Au and Ge atoms averaged over all atoms in layers adjacen...

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Figure 11: Isosurfaces of charge density (0.051 e/Å⁻³) for variants (a) C and (b) D of the Au-fcc(011)/Ge(001)...

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Figure 12: (a) Isosurfaces of the charge density difference for variant C at 0.0064 e/Å⁻³ (yellow and blue cor...

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Figure 13: The charge density differences (0.0045 e/Å⁻³) for variants C (a) and D (b) of the Au-fcc(011)/Ge(00...

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Published 15 Nov 2023

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