How To Install mrchem on Fedora 36
In this tutorial we learn how to install mrchem in Fedora 36. mrchem is A numerical real-space code for molecular electronic structure calculations
Introduction
In this tutorial we learn how to install mrchem on Fedora 36.
What is mrchem
MRChem is a numerical real-space code for molecular electronic structure calculations within the self-consistent field (SCF) approximations of quantum chemistry (Hartree-Fock and Density Functional Theory).
We can use yum or dnf to install mrchem on Fedora 36. In this tutorial we discuss both methods but you only need to choose one of method to install mrchem.
Install mrchem on Fedora 36 Using dnf
Update yum database with dnf using the following command.
sudo dnf makecache --refresh
After updating yum database, We can install mrchem using dnf by running the following command:
sudo dnf -y install mrchem
Install mrchem on Fedora 36 Using yum
Update yum database with yum using the following command.
sudo yum makecache --refresh
After updating yum database, We can install mrchem using yum by running the following command:
sudo yum -y install mrchem
How To Uninstall mrchem on Fedora 36
To uninstall only the mrchem package we can use the following command:
sudo dnf remove mrchem
mrchem Package Contents on Fedora 36
/usr/bin/mrchem
/usr/bin/mrchem.x
/usr/lib/.build-id
/usr/lib/.build-id/cc
/usr/lib/.build-id/cc/8e827638fa583118495ffd4726d1514aacb41b
/usr/lib/python3.10/site-packages/mrchem
/usr/lib/python3.10/site-packages/mrchem/__init__.py
/usr/lib/python3.10/site-packages/mrchem/__pycache__
/usr/lib/python3.10/site-packages/mrchem/__pycache__/__init__.cpython-310.opt-1.pyc
/usr/lib/python3.10/site-packages/mrchem/__pycache__/__init__.cpython-310.pyc
/usr/lib/python3.10/site-packages/mrchem/__pycache__/api.cpython-310.opt-1.pyc
/usr/lib/python3.10/site-packages/mrchem/__pycache__/api.cpython-310.pyc
/usr/lib/python3.10/site-packages/mrchem/__pycache__/cli.cpython-310.opt-1.pyc
/usr/lib/python3.10/site-packages/mrchem/__pycache__/cli.cpython-310.pyc
/usr/lib/python3.10/site-packages/mrchem/__pycache__/config.cpython-310.opt-1.pyc
/usr/lib/python3.10/site-packages/mrchem/__pycache__/config.cpython-310.pyc
/usr/lib/python3.10/site-packages/mrchem/__pycache__/helpers.cpython-310.opt-1.pyc
/usr/lib/python3.10/site-packages/mrchem/__pycache__/helpers.cpython-310.pyc
/usr/lib/python3.10/site-packages/mrchem/__pycache__/periodictable.cpython-310.opt-1.pyc
/usr/lib/python3.10/site-packages/mrchem/__pycache__/periodictable.cpython-310.pyc
/usr/lib/python3.10/site-packages/mrchem/api.py
/usr/lib/python3.10/site-packages/mrchem/cli.py
/usr/lib/python3.10/site-packages/mrchem/config.py
/usr/lib/python3.10/site-packages/mrchem/helpers.py
/usr/lib/python3.10/site-packages/mrchem/input_parser
/usr/lib/python3.10/site-packages/mrchem/input_parser/__init__.py
/usr/lib/python3.10/site-packages/mrchem/input_parser/__pycache__
/usr/lib/python3.10/site-packages/mrchem/input_parser/__pycache__/__init__.cpython-310.opt-1.pyc
/usr/lib/python3.10/site-packages/mrchem/input_parser/__pycache__/__init__.cpython-310.pyc
/usr/lib/python3.10/site-packages/mrchem/input_parser/__pycache__/api.cpython-310.opt-1.pyc
/usr/lib/python3.10/site-packages/mrchem/input_parser/__pycache__/api.cpython-310.pyc
/usr/lib/python3.10/site-packages/mrchem/input_parser/__pycache__/cli.cpython-310.opt-1.pyc
/usr/lib/python3.10/site-packages/mrchem/input_parser/__pycache__/cli.cpython-310.pyc
/usr/lib/python3.10/site-packages/mrchem/input_parser/api.py
/usr/lib/python3.10/site-packages/mrchem/input_parser/cli.py
/usr/lib/python3.10/site-packages/mrchem/input_parser/docs
/usr/lib/python3.10/site-packages/mrchem/input_parser/plumbing
/usr/lib/python3.10/site-packages/mrchem/input_parser/plumbing/__pycache__
/usr/lib/python3.10/site-packages/mrchem/input_parser/plumbing/__pycache__/atoms.cpython-310.opt-1.pyc
/usr/lib/python3.10/site-packages/mrchem/input_parser/plumbing/__pycache__/atoms.cpython-310.pyc
/usr/lib/python3.10/site-packages/mrchem/input_parser/plumbing/__pycache__/exceptions.cpython-310.opt-1.pyc
/usr/lib/python3.10/site-packages/mrchem/input_parser/plumbing/__pycache__/exceptions.cpython-310.pyc
/usr/lib/python3.10/site-packages/mrchem/input_parser/plumbing/__pycache__/getkw.cpython-310.opt-1.pyc
/usr/lib/python3.10/site-packages/mrchem/input_parser/plumbing/__pycache__/getkw.cpython-310.pyc
/usr/lib/python3.10/site-packages/mrchem/input_parser/plumbing/__pycache__/lexer.cpython-310.opt-1.pyc
/usr/lib/python3.10/site-packages/mrchem/input_parser/plumbing/__pycache__/lexer.cpython-310.pyc
/usr/lib/python3.10/site-packages/mrchem/input_parser/plumbing/__pycache__/pyparsing.cpython-310.opt-1.pyc
/usr/lib/python3.10/site-packages/mrchem/input_parser/plumbing/__pycache__/pyparsing.cpython-310.pyc
/usr/lib/python3.10/site-packages/mrchem/input_parser/plumbing/__pycache__/types.cpython-310.opt-1.pyc
/usr/lib/python3.10/site-packages/mrchem/input_parser/plumbing/__pycache__/types.cpython-310.pyc
/usr/lib/python3.10/site-packages/mrchem/input_parser/plumbing/__pycache__/utils.cpython-310.opt-1.pyc
/usr/lib/python3.10/site-packages/mrchem/input_parser/plumbing/__pycache__/utils.cpython-310.pyc
/usr/lib/python3.10/site-packages/mrchem/input_parser/plumbing/__pycache__/validation.cpython-310.opt-1.pyc
/usr/lib/python3.10/site-packages/mrchem/input_parser/plumbing/__pycache__/validation.cpython-310.pyc
/usr/lib/python3.10/site-packages/mrchem/input_parser/plumbing/__pycache__/validation_plumbing.cpython-310.opt-1.pyc
/usr/lib/python3.10/site-packages/mrchem/input_parser/plumbing/__pycache__/validation_plumbing.cpython-310.pyc
/usr/lib/python3.10/site-packages/mrchem/input_parser/plumbing/__pycache__/views.cpython-310.opt-1.pyc
/usr/lib/python3.10/site-packages/mrchem/input_parser/plumbing/__pycache__/views.cpython-310.pyc
/usr/lib/python3.10/site-packages/mrchem/input_parser/plumbing/atoms.py
/usr/lib/python3.10/site-packages/mrchem/input_parser/plumbing/exceptions.py
/usr/lib/python3.10/site-packages/mrchem/input_parser/plumbing/getkw.py
/usr/lib/python3.10/site-packages/mrchem/input_parser/plumbing/lexer.py
/usr/lib/python3.10/site-packages/mrchem/input_parser/plumbing/pyparsing.py
/usr/lib/python3.10/site-packages/mrchem/input_parser/plumbing/types.py
/usr/lib/python3.10/site-packages/mrchem/input_parser/plumbing/utils.py
/usr/lib/python3.10/site-packages/mrchem/input_parser/plumbing/validation.py
/usr/lib/python3.10/site-packages/mrchem/input_parser/plumbing/validation_plumbing.py
/usr/lib/python3.10/site-packages/mrchem/input_parser/plumbing/views.py
/usr/lib/python3.10/site-packages/mrchem/periodictable.py
/usr/share/doc/mrchem
/usr/share/doc/mrchem/CHANGELOG.md
/usr/share/doc/mrchem/CONTRIBUTING.md
/usr/share/doc/mrchem/README.md
/usr/share/doc/mrchem/VERSION
/usr/share/licenses/mrchem
/usr/share/licenses/mrchem/LICENSE
References
Summary
In this tutorial we learn how to install mrchem on Fedora 36 using yum and [dnf]((/fedora/36/dnf/).
title: “How To Install mrchem on Fedora 36” linkTitle: “mrchem” type: “docs” description: “In this tutorial we learn how to install mrchem in Fedora 36. mrchem is A numerical real-space code for molecular electronic structure calculations” date: “2022-08-17” lastmod: “2022-08-17” #image: /images/fedora/36/mrchem-featured.png
Introduction
In this tutorial we learn how to install mrchem on Fedora 36.
What is mrchem
MRChem is a numerical real-space code for molecular electronic structure calculations within the self-consistent field (SCF) approximations of quantum chemistry (Hartree-Fock and Density Functional Theory).
We can use yum or dnf to install mrchem on Fedora 36. In this tutorial we discuss both methods but you only need to choose one of method to install mrchem.
Install mrchem on Fedora 36 Using dnf
Update yum database with dnf using the following command.
sudo dnf makecache --refresh
After updating yum database, We can install mrchem using dnf by running the following command:
sudo dnf -y install mrchem
Install mrchem on Fedora 36 Using yum
Update yum database with yum using the following command.
sudo yum makecache --refresh
After updating yum database, We can install mrchem using yum by running the following command:
sudo yum -y install mrchem
How To Uninstall mrchem on Fedora 36
To uninstall only the mrchem package we can use the following command:
sudo dnf remove mrchem
mrchem Package Contents on Fedora 36
/usr/bin/mrchem
/usr/bin/mrchem.x
/usr/lib/.build-id
/usr/lib/.build-id/a9
/usr/lib/.build-id/a9/0bdab7c2ae859fe8d28e99d8a8d7511b5041ca
/usr/lib/python3.10/site-packages/mrchem
/usr/lib/python3.10/site-packages/mrchem/__init__.py
/usr/lib/python3.10/site-packages/mrchem/__pycache__
/usr/lib/python3.10/site-packages/mrchem/__pycache__/__init__.cpython-310.opt-1.pyc
/usr/lib/python3.10/site-packages/mrchem/__pycache__/__init__.cpython-310.pyc
/usr/lib/python3.10/site-packages/mrchem/__pycache__/api.cpython-310.opt-1.pyc
/usr/lib/python3.10/site-packages/mrchem/__pycache__/api.cpython-310.pyc
/usr/lib/python3.10/site-packages/mrchem/__pycache__/cli.cpython-310.opt-1.pyc
/usr/lib/python3.10/site-packages/mrchem/__pycache__/cli.cpython-310.pyc
/usr/lib/python3.10/site-packages/mrchem/__pycache__/config.cpython-310.opt-1.pyc
/usr/lib/python3.10/site-packages/mrchem/__pycache__/config.cpython-310.pyc
/usr/lib/python3.10/site-packages/mrchem/__pycache__/helpers.cpython-310.opt-1.pyc
/usr/lib/python3.10/site-packages/mrchem/__pycache__/helpers.cpython-310.pyc
/usr/lib/python3.10/site-packages/mrchem/__pycache__/periodictable.cpython-310.opt-1.pyc
/usr/lib/python3.10/site-packages/mrchem/__pycache__/periodictable.cpython-310.pyc
/usr/lib/python3.10/site-packages/mrchem/api.py
/usr/lib/python3.10/site-packages/mrchem/cli.py
/usr/lib/python3.10/site-packages/mrchem/config.py
/usr/lib/python3.10/site-packages/mrchem/helpers.py
/usr/lib/python3.10/site-packages/mrchem/input_parser
/usr/lib/python3.10/site-packages/mrchem/input_parser/__init__.py
/usr/lib/python3.10/site-packages/mrchem/input_parser/__pycache__
/usr/lib/python3.10/site-packages/mrchem/input_parser/__pycache__/__init__.cpython-310.opt-1.pyc
/usr/lib/python3.10/site-packages/mrchem/input_parser/__pycache__/__init__.cpython-310.pyc
/usr/lib/python3.10/site-packages/mrchem/input_parser/__pycache__/api.cpython-310.opt-1.pyc
/usr/lib/python3.10/site-packages/mrchem/input_parser/__pycache__/api.cpython-310.pyc
/usr/lib/python3.10/site-packages/mrchem/input_parser/__pycache__/cli.cpython-310.opt-1.pyc
/usr/lib/python3.10/site-packages/mrchem/input_parser/__pycache__/cli.cpython-310.pyc
/usr/lib/python3.10/site-packages/mrchem/input_parser/api.py
/usr/lib/python3.10/site-packages/mrchem/input_parser/cli.py
/usr/lib/python3.10/site-packages/mrchem/input_parser/docs
/usr/lib/python3.10/site-packages/mrchem/input_parser/plumbing
/usr/lib/python3.10/site-packages/mrchem/input_parser/plumbing/__pycache__
/usr/lib/python3.10/site-packages/mrchem/input_parser/plumbing/__pycache__/atoms.cpython-310.opt-1.pyc
/usr/lib/python3.10/site-packages/mrchem/input_parser/plumbing/__pycache__/atoms.cpython-310.pyc
/usr/lib/python3.10/site-packages/mrchem/input_parser/plumbing/__pycache__/exceptions.cpython-310.opt-1.pyc
/usr/lib/python3.10/site-packages/mrchem/input_parser/plumbing/__pycache__/exceptions.cpython-310.pyc
/usr/lib/python3.10/site-packages/mrchem/input_parser/plumbing/__pycache__/getkw.cpython-310.opt-1.pyc
/usr/lib/python3.10/site-packages/mrchem/input_parser/plumbing/__pycache__/getkw.cpython-310.pyc
/usr/lib/python3.10/site-packages/mrchem/input_parser/plumbing/__pycache__/lexer.cpython-310.opt-1.pyc
/usr/lib/python3.10/site-packages/mrchem/input_parser/plumbing/__pycache__/lexer.cpython-310.pyc
/usr/lib/python3.10/site-packages/mrchem/input_parser/plumbing/__pycache__/pyparsing.cpython-310.opt-1.pyc
/usr/lib/python3.10/site-packages/mrchem/input_parser/plumbing/__pycache__/pyparsing.cpython-310.pyc
/usr/lib/python3.10/site-packages/mrchem/input_parser/plumbing/__pycache__/types.cpython-310.opt-1.pyc
/usr/lib/python3.10/site-packages/mrchem/input_parser/plumbing/__pycache__/types.cpython-310.pyc
/usr/lib/python3.10/site-packages/mrchem/input_parser/plumbing/__pycache__/utils.cpython-310.opt-1.pyc
/usr/lib/python3.10/site-packages/mrchem/input_parser/plumbing/__pycache__/utils.cpython-310.pyc
/usr/lib/python3.10/site-packages/mrchem/input_parser/plumbing/__pycache__/validation.cpython-310.opt-1.pyc
/usr/lib/python3.10/site-packages/mrchem/input_parser/plumbing/__pycache__/validation.cpython-310.pyc
/usr/lib/python3.10/site-packages/mrchem/input_parser/plumbing/__pycache__/validation_plumbing.cpython-310.opt-1.pyc
/usr/lib/python3.10/site-packages/mrchem/input_parser/plumbing/__pycache__/validation_plumbing.cpython-310.pyc
/usr/lib/python3.10/site-packages/mrchem/input_parser/plumbing/__pycache__/views.cpython-310.opt-1.pyc
/usr/lib/python3.10/site-packages/mrchem/input_parser/plumbing/__pycache__/views.cpython-310.pyc
/usr/lib/python3.10/site-packages/mrchem/input_parser/plumbing/atoms.py
/usr/lib/python3.10/site-packages/mrchem/input_parser/plumbing/exceptions.py
/usr/lib/python3.10/site-packages/mrchem/input_parser/plumbing/getkw.py
/usr/lib/python3.10/site-packages/mrchem/input_parser/plumbing/lexer.py
/usr/lib/python3.10/site-packages/mrchem/input_parser/plumbing/pyparsing.py
/usr/lib/python3.10/site-packages/mrchem/input_parser/plumbing/types.py
/usr/lib/python3.10/site-packages/mrchem/input_parser/plumbing/utils.py
/usr/lib/python3.10/site-packages/mrchem/input_parser/plumbing/validation.py
/usr/lib/python3.10/site-packages/mrchem/input_parser/plumbing/validation_plumbing.py
/usr/lib/python3.10/site-packages/mrchem/input_parser/plumbing/views.py
/usr/lib/python3.10/site-packages/mrchem/periodictable.py
/usr/share/doc/mrchem
/usr/share/doc/mrchem/CHANGELOG.md
/usr/share/doc/mrchem/CONTRIBUTING.md
/usr/share/doc/mrchem/README.md
/usr/share/doc/mrchem/VERSION
/usr/share/licenses/mrchem
/usr/share/licenses/mrchem/LICENSE
References
Summary
In this tutorial we learn how to install mrchem on Fedora 36 using yum and [dnf]((/fedora/36/dnf/).