Comparative study of structural and electronic properties of Cu-based multinary semiconductors

Defect physics of the kesterite thin-film solar cell absorber Cu2ZnSnS4

(2010) Shiyou Chen et al.   APPLIED PHYSICS LETTERS

Thermodynamics and kinetics of the copper vacancy in CuInSe2, CuGaSe2, CuInS2, and CuGaS2 from screened-exchange hybrid density functional theory

(2010) Johan Pohl et al.   JOURNAL OF APPLIED PHYSICS

Electronic and optical properties of Cu2ZnSnS4 and Cu2ZnSnSe4

(2010) Clas Persson   JOURNAL OF APPLIED PHYSICS

First-principles modeling of localizeddstates with theGW@LDA+Uapproach

(2010) Hong Jiang et al.   PHYSICAL REVIEW B

Strong Interplay between Structure and Electronic Properties inCuIn(S,Se)2: A First-Principles Study

(2010) Julien Vidal et al.   PHYSICAL REVIEW LETTERS

Quasiparticle Band Gap of ZnO: High Accuracy from the ConventionalG0W0Approach

(2010) Bi-Ching Shih et al.   PHYSICAL REVIEW LETTERS

Crystal and electronic band structure of Cu2ZnSnX4 (X=S and Se) photovoltaic absorbers: First-principles insights

(2009) Shiyou Chen et al.   APPLIED PHYSICS LETTERS

Electronic structure and stability of quaternary chalcogenide semiconductors derived from cation cross-substitution of II-VI andI-III-VI2compounds

(2009) Shiyou Chen et al.   PHYSICAL REVIEW B

Ab initioprocedure for constructing effective models of correlated materials with entangled band structure

(2009) Takashi Miyake et al.   PHYSICAL REVIEW B

Cu2ZnSnS4as a potential photovoltaic material: A hybrid Hartree-Fock density functional theory study

(2009) Joachim Paier et al.   PHYSICAL REVIEW B

Localized and Itinerant States in Lanthanide Oxides United byGW @ LDA+U

(2009) Hong Jiang et al.   PHYSICAL REVIEW LETTERS

Towards sustainable materials for solar energy conversion: Preparation and photoelectrochemical characterization of Cu2ZnSnS4

(2008) Jonathan J. Scragg et al.   ELECTROCHEMISTRY COMMUNICATIONS

Evolution of the bonding mechanism of ZnO under isotropic compression: A first-principles study

(2008) G.C. Zhou et al.   PHYSICA B-CONDENSED MATTER

New routes to sustainable photovoltaics: evaluation of Cu2ZnSnS4as an alternative absorber material

(2008) Jonathan J. Scragg et al.   PHYSICA STATUS SOLIDI B-BASIC SOLID STATE PHYSICS

Screened Coulomb interaction in the maximally localized Wannier basis

(2008) Takashi Miyake et al.   PHYSICAL REVIEW B

GWquasiparticle corrections to theLDA+U∕GGA+Uelectronic structure of bcc hydrogen

(2008) Emmanouil Kioupakis et al.   PHYSICAL REVIEW B