Approximation to density functional theory for the calculation of band gaps of semiconductors LG Ferreira, M Marques, LK Teles Physical Review B 78 (12), 125116, 2008 | 460 | 2008 |
Slater half-occupation technique revisited: the LDA-1/2 and GGA-1/2 approaches for atomic ionization energies and band gaps in semiconductors LG Ferreira, M Marques, LK Teles Aip Advances 1 (3), 2011 | 250 | 2011 |
First-principles calculations of the thermodynamic and structural properties of strained and alloys LK Teles, J Furthmüller, LMR Scolfaro, JR Leite, F Bechstedt Physical Review B 62 (4), 2475, 2000 | 243 | 2000 |
Accurate band gaps of AlGaN, InGaN, and AlInN alloys calculations based on LDA-1/2 approach RR Pelá, C Caetano, M Marques, LG Ferreira, J Furthmüller, LK Teles Applied Physics Letters 98 (15), 2011 | 203 | 2011 |
Structural, electronic, and effective-mass properties of silicon and zinc-blende group-III nitride semiconductor compounds LE Ramos, LK Teles, LMR Scolfaro, JLP Castineira, AL Rosa, JR Leite Physical Review B 63 (16), 165210, 2001 | 185 | 2001 |
Stability and electronic structure of two-dimensional allotropes of group-IV materials F Matusalem, M Marques, LK Teles, F Bechstedt Physical Review B 92 (4), 045436, 2015 | 144 | 2015 |
Phase separation suppression in InGaN epitaxial layers due to biaxial strain A Tabata, LK Teles, LMR Scolfaro, JR Leite, A Kharchenko, T Frey, DJ As, ... Applied physics letters 80 (5), 769-771, 2002 | 141 | 2002 |
Energy gap and optical properties of InxGa1–xN F Bechstedt, J Furthmüller, M Ferhat, LK Teles, LMR Scolfaro, JR Leite, ... physica status solidi (a) 195 (3), 628-633, 2003 | 136 | 2003 |
Structural properties and Raman modes of zinc blende InN epitaxial layers A Tabata, AP Lima, LK Teles, LMR Scolfaro, JR Leite, V Lemos, ... Applied physics letters 74 (3), 362-364, 1999 | 125 | 1999 |
Phase stability, chemical bonds, and gap bowing of alloys: Comparison between cubic and wurtzite structures C Caetano, LK Teles, M Marques, A Dal Pino Jr, LG Ferreira Physical Review B 74 (4), 045215, 2006 | 92 | 2006 |
Coincidence lattices of 2D crystals: Heterostructure predictions and applications DS Koda, F Bechstedt, M Marques, LK Teles The Journal of Physical Chemistry C 120 (20), 10895-10908, 2016 | 86 | 2016 |
Lattice parameter and energy band gap of cubic quaternary alloys M Marques, LK Teles, LMR Scolfaro, JR Leite, J Furthmüller, F Bechstedt Applied physics letters 83 (5), 890-892, 2003 | 83 | 2003 |
Comparing LDA-1/2, HSE03, HSE06 and G0W0 approaches for band gap calculations of alloys RR Pela, M Marques, LK Teles Journal of Physics: Condensed Matter 27 (50), 505502, 2015 | 78 | 2015 |
Full-relativistic calculations of the carrier effective masses and complex dielectric function M Marques, LK Teles, V Anjos, LMR Scolfaro, JR Leite, VN Freire, ... Applied physics letters 82 (18), 3074-3076, 2003 | 77 | 2003 |
Tuning Electronic Properties and Band Alignments of Phosphorene Combined With MoSe2 and WSe2 DS Koda, F Bechstedt, M Marques, LK Teles The Journal of Physical Chemistry C 121 (7), 3862-3869, 2017 | 65 | 2017 |
Trends on band alignments: Validity of Anderson's rule in - and -based van der Waals heterostructures DS Koda, F Bechstedt, M Marques, LK Teles Physical Review B 97 (16), 165402, 2018 | 59 | 2018 |
Influence of structure and thermodynamic stability on electronic properties of two-dimensional SiC, SiGe, and GeC alloys I Guilhon, LK Teles, M Marques, RR Pelá, F Bechstedt Physical Review B 92 (7), 075435, 2015 | 59 | 2015 |
Spinodal decomposition in and alloys LK Teles, LMR Scolfaro, JR Leite, J Furthmüller, F Bechstedt Applied physics letters 80 (7), 1177-1179, 2002 | 55 | 2002 |
Phase separation and gap bowing in zinc-blende InGaN, InAlN, BGaN, and BAlN alloy layers LK Teles, J Furthmüller, LMR Scolfaro, A Tabata, JR Leite, F Bechstedt, ... Physica E: Low-Dimensional Systems and Nanostructures 13 (2-4), 1086-1089, 2002 | 54 | 2002 |
Influence of composition fluctuations and strain on gap bowing in In x Ga 1− x N LK Teles, J Furthmüller, LMR Scolfaro, JR Leite, F Bechstedt Physical Review B 63 (8), 085204, 2001 | 48 | 2001 |