Stabilization and self-passivation of symmetrical grain boundaries by mirror symmetry breaking

PyCDT: A Python toolkit for modeling point defects in semiconductors and insulators

(2018) Danny Broberg et al.   COMPUTER PHYSICS COMMUNICATIONS

Molecular Dynamics Study of High Symmetry Planar Defect Evolution during Growth of CdTe/CdS Films

(2018) Jose J. Chavez et al.   Journal of Physical Chemistry C

First-Principles Studies on Twinnability of Magnesium Alloys: Effects of Yttrium and Lithium on 101¯11¯012 Compression Twinning Deformation Processes

(2018) Won June Kim et al.   METALS AND MATERIALS INTERNATIONAL

Role of Grain Boundaries under Long-Time Radiation

(2018) Yichao Zhu et al.   PHYSICAL REVIEW LETTERS

Selective Solvent-Induced Stabilization of Polar Oxide Surfaces in an Electrochemical Environment

(2018) Su-Hyun Yoo et al.   PHYSICAL REVIEW LETTERS

Local Melting Attracts Grain Boundaries in Colloidal Polycrystals

(2018) Caitlin E. Cash et al.   PHYSICAL REVIEW LETTERS

First-Order Interfacial Transformations with a Critical Point: Breaking the Symmetry at a Symmetric Tilt Grain Boundary

(2018) Shengfeng Yang et al.   PHYSICAL REVIEW LETTERS

Strain-Induced Asymmetric Line Segregation at Faceted Si Grain Boundaries

(2018) Christian H. Liebscher et al.   PHYSICAL REVIEW LETTERS

Point defect engineering in thin-film solar cells

(2018) Ji Sang Park et al.   Nature Reviews Materials

Anomalous Tensile Detwinning in Twinned Nanowires

(2017) Guangming Cheng et al.   PHYSICAL REVIEW LETTERS

Structure of the SnO2(110)−(4×1) Surface

(2017) Lindsay R. Merte et al.   PHYSICAL REVIEW LETTERS

Grain Boundary Structures and Collective Dynamics of Inversion Domains in Binary Two-Dimensional Materials

(2017) Doaa Taha et al.   PHYSICAL REVIEW LETTERS

Interface-induced phenomena in magnetism

(2017) Frances Hellman et al.   REVIEWS OF MODERN PHYSICS

Polymerization of defect states at dislocation cores in InAs

(2016) Ji-Sang Park et al.   JOURNAL OF APPLIED PHYSICS

First-principles study of roles of Cu and Cl in polycrystalline CdTe

(2016) Ji-Hui Yang et al.   JOURNAL OF APPLIED PHYSICS

Review on first-principles study of defect properties of CdTe as a solar cell absorber

(2016) Ji-Hui Yang et al.   SEMICONDUCTOR SCIENCE AND TECHNOLOGY

Grain boundaries in CdTe thin film solar cells: a review

(2016) Jonathan D Major   SEMICONDUCTOR SCIENCE AND TECHNOLOGY

Stabilizing nanostructures in metals using grain and twin boundary architectures

(2016) K. Lu   Nature Reviews Materials

Ab initio and atomistic simulation of local structure and defect segregation on the tilt grain boundaries in silicon

(2015) Vitaly Yu. Lazebnykh et al.   JOURNAL OF APPLIED PHYSICS

Stability and electronic structure of the low-Σgrain boundaries in CdTe: a density functional study

(2015) Ji-Sang Park et al.   NEW JOURNAL OF PHYSICS

Period-doubling reconstructions of semiconductor partial dislocations

(2015) Ji-Sang Park et al.   NPG Asia Materials

Unique Properties of Halide Perovskites as Possible Origins of the Superior Solar Cell Performance

(2014) Wan-Jian Yin et al.   ADVANCED MATERIALS

Grain-Boundary-Enhanced Carrier Collection in CdTe Solar Cells

(2014) Chen Li et al.   PHYSICAL REVIEW LETTERS

First-principles calculations for point defects in solids

(2014) Christoph Freysoldt et al.   REVIEWS OF MODERN PHYSICS

Creating a single twin boundary between two CdTe (111) wafers with controlled rotation angle by wafer bonding

(2013) Ce Sun et al.   APPLIED PHYSICS LETTERS

A genetic algorithm for generating grain boundaries

(2013) Sebastián Echeverri Restrepo et al.   MODELLING AND SIMULATION IN MATERIALS SCIENCE AND ENGINEERING

Origin of the Bismuth-Induced Decohesion of Nickel and Copper Grain Boundaries

(2013) Joongoo Kang et al.   PHYSICAL REVIEW LETTERS

Colloquium: Structural, electronic, and transport properties of silicon nanowires

(2010) Riccardo Rurali   REVIEWS OF MODERN PHYSICS

Anomalous Strength Characteristics of Tilt Grain Boundaries in Graphene

(2010) R. Grantab et al.   SCIENCE

Survey of computed grain boundary properties in face-centered cubic metals: I. Grain boundary energy

(2009) David L. Olmsted et al.   ACTA MATERIALIA