logo

Estimation of volume as a function of pressure

This program estimates volumes of non-molecular and molecular crystals for USPEX input in range of pressures from 0 to 500 GPa.

Authors: Guangrui Qian, Bingxi Li, Maksim Rakitin (python port + web interface).
Elements: comma- or space-separated names of elements
Number of species: comma- or space-separated numbers




Last updated: