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Optical properties of two-dimensional honeycomb crystals graphene, silicene, germanene, and tinene from first principles

New journal of physics, 2014-10, Vol.16 (10), p.105007-13

2014

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Hund's Rule-Driven Dzyaloshinskii-Moriya Interaction at 3d-5d Interfaces

Physical review letters, 2016-12, Vol.117 (24), p.247202-247202

2016

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Linear optical properties in the projector-augmented wave methodology

Physical review. B, Condensed matter and materials physics, 2006-01, Vol.73 (4), Article 045112

2006

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Semiempirical van der Waals correction to the density functional description of solids and molecular structures

Physical review. B, Condensed matter and materials physics, 2006-05, Vol.73 (20), Article 205101

2006

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Direct Band Gap Wurtzite Gallium Phosphide Nanowires

Nano letters, 2013-04, Vol.13 (4), p.1559-1563

2013

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Quasiparticle band structures of the antiferromagnetic transition-metal oxides MnO, FeO, CoO, and NiO

Physical review. B, Condensed matter and materials physics, 2009-06, Vol.79 (23), Article 235114

2009

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Influence of structure and thermodynamic stability on electronic properties of two-dimensional SiC, SiGe, and GeC alloys

Physical review. B, Condensed matter and materials physics, 2015-08, Vol.92 (7), Article 075435

2015

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Attracted by long-range electron correlation : Adenine on graphite

Physical review letters, 2005-10, Vol.95 (18), p.186101.1-186101.4, Article 186101

2005

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Nonmetallic substrates for growth of silicene: an ab initio prediction

Journal of physics. Condensed matter, 2014-05, Vol.26 (18), p.185002-185002

2014

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Silicene-derived phases on Ag(111) substrate versus coverage: Ab initio studies

Physical review. B, Condensed matter and materials physics, 2014-01, Vol.89 (3), Article 035403

2014

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Polytypism in ZnS, ZnSe, and ZnTe: First-principles study

Physical review. B, Condensed matter and materials physics, 2014-06, Vol.89 (24), Article 245308

2014

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Optical Properties of Strained Wurtzite Gallium Phosphide Nanowires

Nano letters, 2016-06, Vol.16 (6), p.3703-3709

2016

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Band discontinuities at Si-TCO interfaces from quasiparticle calculations: Comparison of two alignment approaches

Physical review. B, Condensed matter and materials physics, 2012-01, Vol.85 (3), Article 035305

2012

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Valence-band electronic structure of CdO, ZnO, and MgO from x-ray photoemission spectroscopy and quasi-particle-corrected density-functional theory calculations

Physical review. B, Condensed matter and materials physics, 2009-05, Vol.79 (20), Article 205205

2009

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Strong excitons in novel two-dimensional crystals: Silicane and germanane

Europhysics letters, 2012-05, Vol.98 (3), p.37004

2012

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Branch-point energies and band discontinuities of III-nitrides and III-/II-oxides from quasiparticle band-structure calculations

Applied physics letters, 2009-01, Vol.94 (1)

2009

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Topological α -Sn surface states versus film thickness and strain

Physical review. B, Condensed matter and materials physics, 2014-09, Vol.90 (12), Article 125312

2014

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Energetic stability and magnetic properties of MnO in the rocksalt, wurtzite, and zinc-blende structures: Influence of exchange and correlation

Physical review. B, Condensed matter and materials physics, 2010-10, Vol.82 (16), Article 165109

2010

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Dielectric tensor of monoclinic Ga2O3 single crystals in the spectral range 0.5–8.5 eV

APL materials, 2015-10, Vol.3 (10), p.106106-106106-9

2015

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First-principles calculations of energetics and electronic structure for reconstructed Si ( 111 ) − ( 5 × n ) − Au surfaces

Physical review. B, Condensed matter and materials physics, 2014-10, Vol.90 (16), Article 165407

2014

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Optical properties of silicene, Si/Ag(111), and Si/Ag(110)

Physical review. B, 2018-05, Vol.97 (19), Article 195407

2018

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Surface influence on stability and structure of hexagon-shaped III-V semiconductor nanorods

Journal of applied physics, 2007-09, Vol.102 (6), p.063528-063528-8

2007

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Shape of free and constrained group-IV crystallites : Influence of surface energies

Physical review. B, Condensed matter and materials physics, 2005-09, Vol.72 (12), p.125326.1-125326.9, Article 125326

2005

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Ab-initio theory of semiconductor band structures: New developments and progress

Physica status solidi. B. Basic research, 2009-08, Vol.246 (8), p.1877-1892

2009

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Influence of the composition fluctuations and decomposition on the tunable direct gap and oscillator strength of Ge1-xSnx alloys

Applied physics letters, 2016-02, Vol.108 (9)

2016

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Optical properties of two-dimensional honeycomb crystals graphene, silicene, germanene, and tinene from first principles

Hund's Rule-Driven Dzyaloshinskii-Moriya Interaction at 3d-5d Interfaces

Linear optical properties in the projector-augmented wave methodology

Semiempirical van der Waals correction to the density functional description of solids and molecular structures

Direct Band Gap Wurtzite Gallium Phosphide Nanowires

Quasiparticle band structures of the antiferromagnetic transition-metal oxides MnO, FeO, CoO, and NiO

Influence of structure and thermodynamic stability on electronic properties of two-dimensional SiC, SiGe, and GeC alloys

Attracted by long-range electron correlation : Adenine on graphite

Nonmetallic substrates for growth of silicene: an ab initio prediction

Silicene-derived phases on Ag(111) substrate versus coverage: Ab initio studies

Polytypism in ZnS, ZnSe, and ZnTe: First-principles study

Optical Properties of Strained Wurtzite Gallium Phosphide Nanowires

Band discontinuities at Si-TCO interfaces from quasiparticle calculations: Comparison of two alignment approaches

Valence-band electronic structure of CdO, ZnO, and MgO from x-ray photoemission spectroscopy and quasi-particle-corrected density-functional theory calculations

Strong excitons in novel two-dimensional crystals: Silicane and germanane

Branch-point energies and band discontinuities of III-nitrides and III-/II-oxides from quasiparticle band-structure calculations

Topological α -Sn surface states versus film thickness and strain

Energetic stability and magnetic properties of MnO in the rocksalt, wurtzite, and zinc-blende structures: Influence of exchange and correlation

Dielectric tensor of monoclinic Ga2O3 single crystals in the spectral range 0.5–8.5 eV

First-principles calculations of energetics and electronic structure for reconstructed Si ( 111 ) − ( 5 × n ) − Au surfaces

Optical properties of silicene, Si/Ag(111), and Si/Ag(110)

Surface influence on stability and structure of hexagon-shaped III-V semiconductor nanorods

Shape of free and constrained group-IV crystallites : Influence of surface energies

Ab-initio theory of semiconductor band structures: New developments and progress

Influence of the composition fluctuations and decomposition on the tunable direct gap and oscillator strength of Ge1-xSnx alloys

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