activity
20212026
most citedThermodynamic properties of ε-Fe with thermal electronic excitation effects on vibrational spectra

23 citations · 28 across the 6 of their papers we have counts for

collaborators

6 papers

cond-mat.mtrl-sci2026

Insights into the long-standing controversy over sound velocities in lizardite

Chenxing Luo, Timothy Liao, Hongjin Wang +1

Serpentine minerals are abundant H-bearing phases in the upper mantle and play a central role in water transport in subduction zones. Lizardite is the low-temperature polymorph exp…

cond-mat.mtrl-sci2026

Lattice dynamics and the spectroscopic signatures of H-bond disorder in -AlOOH

Chenxing Luo, Sangjoon Lee, Hongjin Wang +2

Raman and infrared anomalies associated with H-bond symmetrization in -AlOOH, including mode softening and linewidth broadening at 5-10 GPa, occur at significantly lower pressur…

physics.geo-ph2024

Machine learning potential for serpentines

Hongjin Wang, Chenxing Luo, Renata Wentzcovitch

Serpentines are layered hydrous magnesium silicates (MgOSiOHO) formed through serpentinization, a geochemical process that significantly alters the physical pro…

cond-mat.mtrl-sci2023

Ab initio study on the stability and elasticity of brucite

Hongjin Wang, Chenxing Luo, Renata M. Wentzcovitch

Brucite (Mg(OH)) is a mineral of great interest owing to its various applications and roles in geological processes. Its structure, behavior under different conditions, and uni…

physics.comp-ph2023★ 5 cited

pgm: A Python package for free energy calculations within the phonon gas model

Hongjin Wang, Jingyi Zhuang, Zhen Zhang +2

The quasi-harmonic approximation (QHA) is a powerful method that uses the volume dependence of non-interacting phonons to compute the free energy of materials at high pressures (P)…

cond-mat.mtrl-sci2021★ 23 cited

Thermodynamic properties of ε-Fe with thermal electronic excitation effects on vibrational spectra

Jingyi Zhuang, Hongjin Wang, Qi Zhang +1

The thermodynamic properties of hcp-iron (ε-Fe) are essential for investigating planetary cores' internal structure and dynamic properties. Despite their importance to planetary sc…