A Portal Site of Materials Science Simulation

Introduction Here, I explain how we can build a material surface model (slab model) by ASE(Atomic Simulation E…Read More

1. Introduction Various quantum computer simulators are featured on MateriApps. This review describes how to i…Read More

Introduction Here, I write a review of test calculation of Psi4. Official tutorials can be found the following…Read More

Introduction Avogadro is a versatile molecular modeling and visualization tool. Windows, MacOS, and Linux bina…Read More

1. Introduction The molecular dynamics software LAMMPS can be used to handle soft matter problems. In particul…Read More

Abstract OpenMX is a free software for first-principles electronic structure calculations. It is preinstalled …Read More

1. Introduction This review explains how to install Quantum ESPRESSO on macOS (Big Sur) using Homebrew and the…Read More

1. Introduction This review explains how to install HPhi on macOS (Big Sur) using Homebrew and the MateriApps …Read More

1. Introduction This section describes how to use the MateriApps Installer on Linux OS.We have checked it on C…Read More

Introduction flexible DM-NRG is an open-source program that solves impurity models by Numerical Renormalizatio…Read More