How to Install and Uninstall nwchem Package on Ubuntu 20.04 LTS (Focal Fossa)

Last updated: November 06,2024

1. Install "nwchem" package

Please follow the guidelines below to install nwchem on Ubuntu 20.04 LTS (Focal Fossa)


    
        
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                sudo apt update
            
                    
    
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                sudo apt install
            
                        
                nwchem
            
                    
    
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2. Uninstall "nwchem" package

This is a short guide on how to uninstall nwchem on Ubuntu 20.04 LTS (Focal Fossa):


    
        
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                sudo apt remove
            
                        
                nwchem
            
                    
    
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                sudo apt autoclean && sudo apt autoremove
            
                    
    
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3. Information about the nwchem package on Ubuntu 20.04 LTS (Focal Fossa)

Package: nwchem
Architecture: amd64
Version: 7.0.0-2
Priority: optional
Section: universe/science
Origin: Ubuntu
Maintainer: Ubuntu Developers
Original-Maintainer: Debichem Team
Bugs: https://bugs.launchpad.net/ubuntu/+filebug
Installed-Size: 64263
Depends: mpi-default-bin, nwchem-data (= 7.0.0-2), libblas3 | libblas.so.3, libc6 (>= 2.29), libgcc-s1 (>= 4.0), libgfortran5 (>= 8), liblapack3 | liblapack.so.3, libopenmpi3 (>= 4.0.3~rc4), libpython3.8 (>= 3.8.2), libscalapack-openmpi2.1 (>= 2.1.0)
Filename: pool/universe/n/nwchem/nwchem_7.0.0-2_amd64.deb
Size: 12437424
MD5sum: 945c4e64c58e546eddf1f65ba70200eb
SHA1: 1e5e0671dc5740be78899ef7b605e3e48884dc44
SHA256: a271932d6027473a5c933a886bc02421b2bd64faf0dab23fdc08156bbd9698ed
Homepage: http://www.nwchem-sw.org
Description: High-performance computational chemistry software
Description-md5: 899a9172099bec4f0f9b7a3cd72a69ce