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Brian Puchala

university of michigan

H指数:21

被引数:1,568

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CASM Monte Carlo: Calculations of the thermodynamic and kinetic properties of complex multicomponent crystals

CASM Monte Carlo：复杂多组分晶体热力学和动力学性质的计算

Computational Materials Science

IF3.3

2025-08-270

OAAI

Chemomechanics in alloy phase stability

PHYSICAL REVIEW MATERIALS

IF3.4

2024-03-122

OA

CASM - A software package for first-principles based study of multicomponent crystalline solids

CASM-用于基于第一性原理的多组分结晶固体研究的软件包

COMPUTATIONAL MATERIALS SCIENCE

IF3.3

2023-01-0129

OAAI

Dissolution enables dolomite crystal growth near ambient conditions

IF45.8

2023-01-010

PRE

Distortion-stabilized ordered structures in A2BB'O7 mixed pyrochlores

NPJ COMPUTATIONAL MATERIALS

IF11.9

2019-01-1424

OAAI

Resolving phase stability in the Ti-O binary with first-principles statistical mechanics methods

PHYSICAL REVIEW MATERIALS

IF3.4

2018-03-3030

OAAI

Symmetry-adapted order parameters and free energies for solids undergoing order-disorder phase transitions

PHYSICAL REVIEW B

IF3.7

2017-10-2345

OAAI

Misfit-driven β′′′ precipitate composition and morphology in Mg-Nd alloys

ACTA MATERIALIA

IF9.3

2017-09-0138

OAAI

A comparison of Redlich-Kister polynomial and cubic spline representations of the chemical potential in phase field computations

COMPUTATIONAL MATERIALS SCIENCE

IF3.3

2017-02-0120

OAAI

On the early stages of precipitation in dilute Mg-Nd alloys

ACTA MATERIALIA

IF9.3

2016-04-01126

PREAI

Ab initio energetics of charge compensating point defects: A case study on MgO (vol 73, pg 41, 2013)

COMPUTATIONAL MATERIALS SCIENCE

IF3.3

2015-11-011

PREAI

Ti- and Zr-based metal-air batteries

Ti和Zr基金属空气电池

JOURNAL OF POWER SOURCES

IF7.9

2013-11-0112

PREAI

Thermodynamics of the Zr-O system from first-principles calculations

PHYSICAL REVIEW B

IF3.7

2013-09-30249

PREAI

Ab initio energetics of charge compensating point defects: A case study on MgO

电荷补偿点缺陷的从头算能量学: 以MgO为例

COMPUTATIONAL MATERIALS SCIENCE

IF3.3

2013-06-0113

PREAI

A-Site Diffusion in La1-xSrxMnO3: Ab Initio and Kinetic Monte Carlo Calculations

JOURNAL OF THE ELECTROCHEMICAL SOCIETY

IF3.3

2013-05-3012

OAAI

Atomistic modeling of As diffusion in ZnO (vol 85, 064106, 2012)

PHYSICAL REVIEW B

IF3.7

2013-03-040

OAAI

Stable interstitial dopant-vacancy complexes in ZnO (vol 85, 195207, 2012)

PHYSICAL REVIEW B

IF3.7

2013-02-260

OAAI

Ab initio study of the strain dependent thermodynamics of Bi doping in GaAs

PHYSICAL REVIEW B

IF3.7

2012-08-2846

OAAI

Stable interstitial dopant-vacancy complexes in ZnO

PHYSICAL REVIEW B

IF3.7

2012-05-1832

OAAI

Atomistic modeling of As diffusion in ZnO

PHYSICAL REVIEW B

IF3.7

2012-02-1027

PREAI