How to Install and Uninstall ergo Package on Kali Linux

Last updated: May 19,2024

1. Install "ergo" package

In this section, we are going to explain the necessary steps to install ergo on Kali Linux


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

This guide covers the steps necessary to uninstall ergo on Kali Linux:


    
        
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                sudo apt remove
            
                        
                ergo
            
                    
    
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                sudo apt autoclean && sudo apt autoremove
            
                    
    
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3. Information about the ergo package on Kali Linux

Package: ergo
Version: 3.8-1
Installed-Size: 2606
Maintainer: Debichem Team
Architecture: amd64
Depends: ergo-data (>= 3.7), libatlas3-base, libc6 (>= 2.27), libgcc1 (>= 1:3.0), libgomp1 (>= 4.9), liblapack3 | liblapack.so.3, libstdc++6 (>= 5.2)
Size: 828456
SHA256: ced90ece4bbe49a47ecf8610723db166c9ad8b1ee54854e0c7c6876ea72b755b
SHA1: 3e957475a57884c8845e4820c9add4c61ce48a96
MD5sum: dcadde6349a8c070d68acd0aadcc99a9
Description: Quantum chemistry program for large-scale calculations
ErgoSCF is a quantum chemistry program for large-scale self-consistent field
calculations. It employs modern linear scaling techniques like fast multipole
methods, hierarchic sparse matrix algebra, density matrix purification, and
efficient integral screening. Linear scaling is achieved not only in terms of
CPU usage but also memory utilization. It uses Gaussian basis sets.
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It can compute single-point energies for the following methods:
* Restricted and unrestricted Hartree-Fock (HF) theory
* Restricted and unrestricted Kohn-Sham density functional theory (DFT)
* Full Configuration-Interaction (FCI)
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The following Exchange-Correlational (XC) density functionals are included:
* Local Density Approximation (LDA)
* Gradient-corrected (GGA) XC functionals BLYP, BP86, PW91 and PBE
* Hybrid XC functionals B3LYP, BHandHLYP, PBE0 and CAMB3LYP
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Further features include:
* Linear response calculations (polarizabilities and excitation energies) for
restricted reference densities
* External electric fields
* Electron dynamics via Time-Dependent Hartree-Fock (TDHF)
Description-md5:
Homepage: http://ergoscf.org/
Section: science
Priority: optional
Filename: pool/main/e/ergo/ergo_3.8-1_amd64.deb