How to Install and Uninstall openmx Package on Ubuntu 21.10 (Impish Indri)

Last updated: May 09,2024

1. Install "openmx" package

This tutorial shows how to install openmx on Ubuntu 21.10 (Impish Indri)


    
        
            $
        

        
            
                sudo apt update
            
                    
    
    Copied


    
        
            $
        

        
            
                sudo apt install
            
                        
                openmx
            
                    
    
    Copied

2. Uninstall "openmx" package

Please follow the guidance below to uninstall openmx on Ubuntu 21.10 (Impish Indri):


    
        
            $
        

        
            
                sudo apt remove
            
                        
                openmx
            
                    
    
    Copied


    
        
            $
        

        
            
                sudo apt autoclean && sudo apt autoremove
            
                    
    
    Copied

3. Information about the openmx package on Ubuntu 21.10 (Impish Indri)

Package: openmx
Architecture: amd64
Version: 3.8.5+dfsg1-1build1
Priority: extra
Section: universe/science
Origin: Ubuntu
Maintainer: Ubuntu Developers
Original-Maintainer: Debian Science Team
Bugs: https://bugs.launchpad.net/ubuntu/+filebug
Installed-Size: 4399
Depends: libblas3 | libblas.so.3, libc6 (>= 2.29), libfftw3-double3 (>= 3.3.5), libgcc-s1 (>= 4.0), libgfortran5 (>= 8), libgomp1 (>= 4.9), liblapack3 | liblapack.so.3, libopenmpi3 (>= 4.0.3~rc4)
Recommends: openmx-data
Filename: pool/universe/o/openmx/openmx_3.8.5+dfsg1-1build1_amd64.deb
Size: 1389364
MD5sum: 6da0fa0e7d4b80f7a849c19b39641337
SHA1: 19dc02763aa51f27b1966ddebfb4d6d593c11fe5
SHA256: bc6fef3e84643aef8758abc964a2f88f2765890b54293dbbe2e039da6d10ef5f
SHA512: d8bfa23ceb376df1dc476e8000b84b363eee23b5ec1e3e4a69e55135af20f7bb2afc374a4f8148e655cf28735e124d4598f381d9c48d53abd19993717bc9feb0
Homepage: http://www.openmx-square.org/
Description-en: package for nano-scale material simulations
OpenMX (Open source package for Material eXplorer) is a program package for
nano-scale material simulations based on density functional theories (DFT),
norm-conserving pseudopotentials and pseudo-atomic localized
basis functions. Since the code is designed for the realization of
large-scale ab initio calculations on parallel computers, it is anticipated
that OpenMX can be a useful and powerful tool for nano-scale material sciences
in a wide variety of systems such as biomaterials, carbon nanotubes, magnetic
materials, and nanoscale conductors.
Description-md5: 5058437646b0e4a8649ba0a918c68454