4.1 Article Proceedings Paper

Structure Prediction for PbS and ZnO at Different Pressures and Visualization of the Energy Landscapes

Related references

Note: Only part of the references are listed.
Article Chemistry, Multidisciplinary

Addressing chemical diversity by employing the energy landscape concept

Martin Jansen et al.

ACTA CRYSTALLOGRAPHICA A-FOUNDATION AND ADVANCES (2010)

Article Chemistry, Physical

Molecular Precursor Route to a Metastable Form of Zinc Oxide

Carlos Lizandara Pueyo et al.

CHEMISTRY OF MATERIALS (2010)

Article Physics, Condensed Matter

Pressure-induced orthorhombic structure of PbS

Andrzej Grzechnik et al.

JOURNAL OF PHYSICS-CONDENSED MATTER (2010)

Article Physics, Multidisciplinary

A Raman study of high-pressure phases of lead chalcogenides PbX (X=S, Se, Te)

Yu. S. Ponosov et al.

HIGH PRESSURE RESEARCH (2009)

Review Metallurgy & Metallurgical Engineering

Prediction, determination and validation of phase diagrams via the global study of energy landscapes

J. C. Schoen et al.

INTERNATIONAL JOURNAL OF MATERIALS RESEARCH (2009)

Article Chemistry, Physical

Structural and electronic properties of ZnO under high pressure

Shouxin Cui et al.

JOURNAL OF ALLOYS AND COMPOUNDS (2009)

Review Chemistry, Physical

Free enthalpy landscape of SrO

J. C. Schoen et al.

JOURNAL OF CHEMICAL PHYSICS (2008)

Article Chemistry, Physical

Optimization methods for finding minimum energy paths

Daniel Sheppard et al.

JOURNAL OF CHEMICAL PHYSICS (2008)

Review Chemistry, Physical

Crystal structure prediction from first principles

Scott M. Woodley et al.

NATURE MATERIALS (2008)

Review Chemistry, Physical

From crystal structure prediction to polymorph prediction: interpreting the crystal energy landscape

Sarah L. Price

PHYSICAL CHEMISTRY CHEMICAL PHYSICS (2008)

Article Materials Science, Multidisciplinary

Structure prediction based on ab initio simulated annealing for boron nitride

K. Doll et al.

PHYSICAL REVIEW B (2008)

Article Engineering, Mechanical

CuO, ZrO2 and ZnO nanoparticles as antiwear additive in oil lubricants

A. Hernandez Battez et al.

Article Chemistry, Physical

Global exploration of the energy landscape of solids on the ab initio level

K. Doll et al.

PHYSICAL CHEMISTRY CHEMICAL PHYSICS (2007)

Article Materials Science, Multidisciplinary

Metallization of aluminum hydride at high pressures: A first-principles study

Chris J. Pickard et al.

PHYSICAL REVIEW B (2007)

Article Physics, Multidisciplinary

Observation of depolarized ZnO(0001) monolayers: Formation of unreconstructed planar sheets

C. Tusche et al.

PHYSICAL REVIEW LETTERS (2007)

Article Chemistry, Physical

Crystal structure prediction using ab initio evolutionary techniques:: Principles and applications

Artem R. Oganov et al.

JOURNAL OF CHEMICAL PHYSICS (2006)

Article Chemistry, Multidisciplinary

High-pressure X-ray investigation of zincite ZnO single crystals using diamond anvils with an improved shape

H Sowa et al.

JOURNAL OF APPLIED CRYSTALLOGRAPHY (2006)

Article Chemistry, Multidisciplinary

CMPZ -: an algorithm for the efficient comparison of periodic structures

R Hundt et al.

JOURNAL OF APPLIED CRYSTALLOGRAPHY (2006)

Article Chemistry, Physical

Ab initio computation of low-temperature phase diagrams exhibiting miscibility gaps

JC Schon et al.

PHYSICAL CHEMISTRY CHEMICAL PHYSICS (2006)

Review Physics, Applied

A comprehensive review of ZnO materials and devices -: art. no. 041301

U Ozgür et al.

JOURNAL OF APPLIED PHYSICS (2005)

Article Chemistry, Physical

How many dimensions are required to approximate the potential energy landscape of a model protein?

T Komatsuzaki et al.

JOURNAL OF CHEMICAL PHYSICS (2005)

Article Chemistry, Physical

Structure prediction of high-pressure phases for alkali metal sulfides

JC Schön et al.

JOURNAL OF CHEMICAL PHYSICS (2004)

Article Engineering, Electrical & Electronic

Studies on PBS and PBSE detectors for IR system

XF Liu et al.

INTERNATIONAL JOURNAL OF INFRARED AND MILLIMETER WAVES (2000)