Khagendra Baral - Publications, H-index & Citations

Khagendra Baral

alabama 35487

12H指数

21论文数

367被引数

收录论文 7

发表时间

Modeling Equilibrium Solid–Liquid Interfaces under Effective Constant Chemical Potential Using Machine Learning Interatomic Potentials 利用机器学习原子间势能对有效恒定化学势下的平衡固-液界面进行建模

The Journal of Physical Chemistry A

IF2.8

2025-11-20

PREAI

Ademola Soyemi; Khagendra Baral; Tibor Szilvási

Application of machine learning interatomic potentials in heterogeneous catalysis 机器学习原子间势在多相催化中的应用

JOURNAL OF CATALYSIS

IF6.5

2025-06-14

PREAI

Olajide, Gbolagade; Baral, Khagendra; Ezendu, Sophia; Soyemi, Ademola; Szilvasi, Tibor

First-Principles Calculations of Thermoelectric Transport Properties of Quaternary and Ternary Bulk Chalcogenide Crystals

MATERIALS

IF3.2

2022-04-13

OAAI

Hasan, Sahib; San, Saro; Baral, Khagendra; Li, Neng; Rulis, Paul; Ching, Wai-Yim

Temperature-Dependent Properties of Molten Li2BeF4 Salt Using Ab Initio Molecular Dynamics 从头算分子动力学研究熔融Li2BeF4盐的温度依赖性

ACS OMEGA

IF4.3

2021-07-21

OAAI

Baral, Khagendra; San, Saro; Sakidja, Ridwan; Couet, Adrien; Sridharan, Kumar; Ching, Wai-Yim

Structural and physical properties of 99 complex bulk chalcogenides crystals using first-principles calculations

SCIENTIFIC REPORTS

IF3.9

2021-05-10

OAAI

Hasan, Sahib; Baral, Khagendra; Li, Neng; Ching, Wai-Yim

Understanding the atomistic origin of hydration effects in single and mixed bulk alkali-silicate glasses

JOURNAL OF THE AMERICAN CERAMIC SOCIETY

IF3.8

2018-07-26

OAAI

Baral, Khagendra; Li, Aize; Ching, Wai-Yim

Ab initio Modeling of the Electronic Structures and Physical Properties of a-Si1-xGexO2 Glass (x=0 to 1)

JOURNAL OF THE AMERICAN CERAMIC SOCIETY

IF3.8

2016-07-28

PREAI

Baral, Khagendra; Adhikari, Puja; Ching, Wai-Yim

研究方向