Results 221 to 230 of about 978,564 (238)

First-Principles Approaches to the Structure and Reactivity of Atmospherically Relevant Aqueous Interfaces

Chemical Reviews, 2006
Christopher J Mundy, I-Feng W Kuo
exaly  

First-principles calculations for point defects in solids

Reviews of Modern Physics, 2014
Christoph Freysoldt, Blazej Grabowski, Tilmann Hickel   +2 more
exaly  

First-principles calculations for Dzyaloshinskii–Moriya interaction

Nature Reviews Physics, 2022
exaly  

First-Principle Calculations

2016
openaire   +1 more source

Electron-phonon interactions from first principles

Reviews of Modern Physics, 2017
Feliciano Giustino
exaly  

First principles phonon calculations in materials science

Scripta Materialia, 2015
Atsushi Togo, Isao Tanaka
exaly  

Origin of Outstanding Stability in the Lithium Solid Electrolyte Materials: Insights from Thermodynamic Analyses Based on First-Principles Calculations

ACS Applied Materials & Interfaces, 2015
Yizhou Zhu, Xingfeng He, Yifei Mo
exaly  

Stability of (Ti, M)C (M = Nb, V, Mo and W) carbide in steels using first-principles calculations

Acta Materialia, 2012
Jae Hoon Jang, Chang-hoon Lee, Yoon-Uk Heo   +2 more
exaly  

Phase stability in the Fe–Ni system: Investigation by first-principles calculations and atomistic simulations

Acta Materialia, 2005
Yuri Mishin
exaly  

Principles -- Indication and Prospects For Preoperative Irradiation

Ca-A Cancer Journal for Clinicians, 1967
exaly