Optical conductivity by HΦ
Introduction HΦ (HPhi) is a quantum lattice model solver based on the so-called exact diagonalization method, …Read More
Long and Winding Road to XenonPy
Introduction: Xenon is a Python tool for searching for materials using machine learning. Here, we will install…Read More
Bader charge analysis of NaCl
There are many possible ways to partition the total electron density into contributions from each atom. One po…Read More
How to use VESTA
Introduction VESTA is software for visualizing crystal structures. This software is user-friendly, and can eas…Read More
mptensor (v0.2) on sekirei (ISSP System B) (2020.02.01)
Introduction Computation with tensor representation is the current fashion, with Google’s TensorFlow as …Read More
Molecular dynamics simulation of a peptide chain using Gromacs
Introduction Gromacs is open source software that performs molecular dynamics simulations. It has a number of …Read More
Calculation of the stress-strain curve of aluminum using LAMMPS
Introduction LAMMPS is one of the representative open-source software for molecular dynamics, and is widely us…Read More
Review Movie of FermiSurfer
Demonstration from download FermiSurfer to displaying Fermi surfaces Download/Install/Launch FermiSurfe…Read More
Example of ALPS: Application of QMC to the Heisenberg model
Introduction ALPS is a numerical simulation library where numerical methods are implemented such as density ma…Read More
Calculating static and dynamical susceptibilities of the one-dimensional Heisenberg model by DSQSS.
Introduction DSQSS is a computational library of continuous-time quantum Monte Carlo methods. The spin system …Read More