Structural, electronic and optical properties of LiNbO3 using GGA-PBE and TB-mBJ functionals: A DFT study

Optical and electronic properties of orthorhombic and trigonal AXO3(A=Cd, Zn; X=Sn, Ge): First principle calculation

(2016) Haci Ozisik et al.   FERROELECTRICS

A Lithium Niobate High-Temperature Sensor for Energy System Applications

(2016) Md Rashedul H. Sarker et al.   IEEE SENSORS JOURNAL

Aberration Corrected STEM Imaging of Domain Walls in Congruent LiNbO 3

(2016) Debangshu Mukherjee et al.   MICROSCOPY AND MICROANALYSIS

Reproducibility in density functional theory calculations of solids

(2016) K. Lejaeghere et al.   SCIENCE

First-principles study on phase transition and ferroelectricity in lithium niobate and tantalate

(2015) Kazuaki Toyoura et al.   JOURNAL OF APPLIED PHYSICS

Growth and photorefractive properties of near-stoichiometric Pr:Ce codoping lithium niobate crystals

(2015) Zhaopeng Xu et al.   OPTIK

Ferroelectric properties of RbNbO3 and RbTaO3

(2015) A. I. Lebedev   PHYSICS OF THE SOLID STATE

Density functional theory: Its origins, rise to prominence, and future

(2015) R. O. Jones   REVIEWS OF MODERN PHYSICS

Energy band gap and optical properties of lithium niobate from ab initio calculations

(2013) S. Mamoun et al.   COMPUTATIONAL MATERIALS SCIENCE

Merits and limits of the modified Becke-Johnson exchange potential

(2011) David Koller et al.   PHYSICAL REVIEW B

Electronic structure calculations with the Tran-Blaha modified Becke-Johnson density functional

(2010) David J. Singh   PHYSICAL REVIEW B

LiNbO3ground- and excited-state properties from first-principles calculations

(2008) W. G. Schmidt et al.   PHYSICAL REVIEW B

First-principles study of microscopic properties of the Nb antisite inLiNbO3: Comparison to phenomenological polaron theory

(2008) H. H. Nahm et al.   PHYSICAL REVIEW B