How To Install openmx-openmpi on CentOS 7

In this tutorial we learn how to install openmx-openmpi on CentOS 7. openmx-openmpi is openmx - openmpi version

Introduction

In this tutorial we learn how to install openmx-openmpi on CentOS 7.

What is openmx-openmpi

OpenMX (Open source package for Material eXplorer) is a software package for nano-scale material simulations based on density functional theories (DFT), norm-conserving pseudopotentials, and pseudo-atomic localized basis functions. This package contains the openmpi version.

We can use yum or dnf to install openmx-openmpi on CentOS 7. In this tutorial we discuss both methods but you only need to choose one of method to install openmx-openmpi.

Install openmx-openmpi on CentOS 7 Using yum

Update yum database with yum using the following command.

sudo yum makecache

After updating yum database, We can install openmx-openmpi using yum by running the following command:

sudo yum -y install openmx-openmpi

Install openmx-openmpi on CentOS 7 Using dnf

If you don’t have dnf installed you can install DNF on CentOS 7 first. Update yum database with dnf using the following command.

sudo dnf makecache

After updating yum database, We can install openmx-openmpi using dnf by running the following command:

sudo dnf -y install openmx-openmpi

How To Uninstall openmx-openmpi on CentOS 7

To uninstall only the openmx-openmpi package we can use the following command:

sudo dnf remove openmx-openmpi

References

Summary

In this tutorial we learn how to install openmx-openmpi on CentOS 7 using yum and dnf.