Welcome to Minerals Cloud!

We study materials properties and predict their effects on planetary structure and processes.

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EPAW

A code for evolutionary optimization of PAW datasets especially for high-pressure applications

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qha

A Powerful Python toolkit for quasi-harmonic approximation

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phq

Temperature-dependent phonon quasi-particle dispersions of complex crystals from first principles

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EquationsOfState.jl

A Julia package for fitting the equation of state of solids under pressure

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escpy

Necessary and sufficient elastic stability conditions in various crystal systems

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geothermpy

A Python package that can calculate the isentropic geotherm from thermodynamic properties

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About Us


Renata M. M. Wentzcovitch PI

Research in her group is devoted to computational quantum mechanical studies of materials. She addresses electronic, structural, and vibrational properties from a fundamental and inter-related perspective. She develops and applies simulation methods to investigate materials properties at high pressures and temperatures, particularly in mineral physics and geophysics, discovery of materials at ultra-high pressures, H2O-ice physics, complex oxides, and crystalline defects.

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Renata M. M. Wentzcovitch

singularitti

Qi Zhang

Ph.D. student, Maintainer of the organization

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zhenzhang305

Zhen Zhang

Ph.D. student, Contributor to the organization

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chazeon

Chenxing Luo

Ph.D. student, Contributor to the organization

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yangsun

Yang Sun

Ph.D., Contributor to the organization

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underhill1886

Hongjin Wang

M.S. student, Contributor to the organization

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jappoker

Jingyi Zhuang

Ph.D. student, Contributor to the organization

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