How To Install mpqc-data on Fedora 36

In this tutorial we learn how to install mpqc-data in Fedora 36. mpqc-data is Atom info and basis sets from MPQC

Introduction

In this tutorial we learn how to install mpqc-data on Fedora 36.

What is `mpqc-data`

Atom info and basis sets from MPQC.

We can use yum or dnf to install mpqc-data on Fedora 36. In this tutorial we discuss both methods but you only need to choose one of method to install mpqc-data.

Install mpqc-data 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 mpqc-data using dnf by running the following command:

sudo dnf -y install mpqc-data

Install mpqc-data 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 mpqc-data using yum by running the following command:

sudo yum -y install mpqc-data

How To Uninstall mpqc-data on Fedora 36

To uninstall only the mpqc-data package we can use the following command:

sudo dnf remove mpqc-data

mpqc-data Package Contents on Fedora 36

/usr/share/licenses/mpqc-data
/usr/share/licenses/mpqc-data/COPYING
/usr/share/licenses/mpqc-data/COPYING.LIB
/usr/share/licenses/mpqc-data/LICENSE
/usr/share/mpqc
/usr/share/mpqc/2.3.1
/usr/share/mpqc/2.3.1/atominfo.kv
/usr/share/mpqc/2.3.1/basis
/usr/share/mpqc/2.3.1/basis/3-21PPg.kv
/usr/share/mpqc/2.3.1/basis/3-21PPgS.kv
/usr/share/mpqc/2.3.1/basis/3-21g.kv
/usr/share/mpqc/2.3.1/basis/3-21gS.kv
/usr/share/mpqc/2.3.1/basis/4-31g.kv
/usr/share/mpqc/2.3.1/basis/6-311PPgL2d_2pR.kv
/usr/share/mpqc/2.3.1/basis/6-311PPgL3df_3pdR.kv
/usr/share/mpqc/2.3.1/basis/6-311PPgSS.kv
/usr/share/mpqc/2.3.1/basis/6-311g.kv
/usr/share/mpqc/2.3.1/basis/6-311gL2df_2pdR.kv
/usr/share/mpqc/2.3.1/basis/6-311gS.kv
/usr/share/mpqc/2.3.1/basis/6-311gSS.kv
/usr/share/mpqc/2.3.1/basis/6-31PPg.kv
/usr/share/mpqc/2.3.1/basis/6-31PPgS.kv
/usr/share/mpqc/2.3.1/basis/6-31PPgSS.kv
/usr/share/mpqc/2.3.1/basis/6-31PgS.kv
/usr/share/mpqc/2.3.1/basis/6-31g.kv
/usr/share/mpqc/2.3.1/basis/6-31gS.kv
/usr/share/mpqc/2.3.1/basis/6-31gSS.kv
/usr/share/mpqc/2.3.1/basis/aug-cc-pcv5z.kv
/usr/share/mpqc/2.3.1/basis/aug-cc-pcvdz.kv
/usr/share/mpqc/2.3.1/basis/aug-cc-pcvqz.kv
/usr/share/mpqc/2.3.1/basis/aug-cc-pcvtz.kv
/usr/share/mpqc/2.3.1/basis/aug-cc-pv5z.kv
/usr/share/mpqc/2.3.1/basis/aug-cc-pv6z.kv
/usr/share/mpqc/2.3.1/basis/aug-cc-pvdz.kv
/usr/share/mpqc/2.3.1/basis/aug-cc-pvqz.kv
/usr/share/mpqc/2.3.1/basis/aug-cc-pvtz.kv
/usr/share/mpqc/2.3.1/basis/cc-pcv5z.kv
/usr/share/mpqc/2.3.1/basis/cc-pcvdz.kv
/usr/share/mpqc/2.3.1/basis/cc-pcvqz.kv
/usr/share/mpqc/2.3.1/basis/cc-pcvtz.kv
/usr/share/mpqc/2.3.1/basis/cc-pv5z.kv
/usr/share/mpqc/2.3.1/basis/cc-pv6z.kv
/usr/share/mpqc/2.3.1/basis/cc-pvdz.kv
/usr/share/mpqc/2.3.1/basis/cc-pvqz.kv
/usr/share/mpqc/2.3.1/basis/cc-pvtz.kv
/usr/share/mpqc/2.3.1/basis/dz_LdunningR.kv
/usr/share/mpqc/2.3.1/basis/dzp_LdunningR.kv
/usr/share/mpqc/2.3.1/basis/dzp_P_diffuse_LdunningR.kv
/usr/share/mpqc/2.3.1/basis/midi_LhuzinagaR.kv
/usr/share/mpqc/2.3.1/basis/mini_LhuzinagaR.kv
/usr/share/mpqc/2.3.1/basis/mini_LscaledR.kv
/usr/share/mpqc/2.3.1/basis/nasa_ames_ano.kv
/usr/share/mpqc/2.3.1/basis/pc-0-aug.kv
/usr/share/mpqc/2.3.1/basis/pc-0.kv
/usr/share/mpqc/2.3.1/basis/pc-1-aug.kv
/usr/share/mpqc/2.3.1/basis/pc-1.kv
/usr/share/mpqc/2.3.1/basis/pc-2-aug.kv
/usr/share/mpqc/2.3.1/basis/pc-2.kv
/usr/share/mpqc/2.3.1/basis/pc-3-aug.kv
/usr/share/mpqc/2.3.1/basis/pc-3.kv
/usr/share/mpqc/2.3.1/basis/pc-4-aug.kv
/usr/share/mpqc/2.3.1/basis/pc-4.kv
/usr/share/mpqc/2.3.1/basis/sto-2g.kv
/usr/share/mpqc/2.3.1/basis/sto-3g.kv
/usr/share/mpqc/2.3.1/basis/sto-3gS.kv
/usr/share/mpqc/2.3.1/basis/sto-6g.kv
/usr/share/mpqc/2.3.1/basis/tz_LdunningR.kv
/usr/share/mpqc/2.3.1/ccarunproc
/usr/share/mpqc/2.3.1/elisp
/usr/share/mpqc/2.3.1/elisp/SC.el
/usr/share/mpqc/2.3.1/elisp/compile.el
/usr/share/mpqc/2.3.1/elisp/keyval.el
/usr/share/mpqc/2.3.1/elisp/mpqc.el
/usr/share/mpqc/2.3.1/magic
/usr/share/mpqc/2.3.1/mpqcrunproc
/usr/share/mpqc/2.3.1/perl
/usr/share/mpqc/2.3.1/perl/AtomicBases.pm
/usr/share/mpqc/2.3.1/perl/AtomicBasis.pm
/usr/share/mpqc/2.3.1/perl/Molecule.pm
/usr/share/mpqc/2.3.1/perl/QCParse.pm
/usr/share/mpqc/2.3.1/perl/QCResult.pm

References

mpqc-data website

Summary

In this tutorial we learn how to install mpqc-data on Fedora 36 using yum and [dnf]((/fedora/36/dnf/).