Debian 12 (Bookworm) native package

quantum-espresso

Electronic-Structure and Ab-Initio Molecular Dynamics Suite

Packages / Debian 12 (Bookworm) / science / quantum-espresso

[Source: espresso]

Package: quantum-espresso (6.7-2+b1)

Maintainers:

Debichem Team

External Resources:

Homepage: [www.quantum-espresso.org]

Similar packages:

[quantum-espresso-data]
Electronic-Structure and Ab-Initio Molecular Dynamics Suite (Documentation)

Electronic-Structure and Ab-Initio Molecular Dynamics Suite

Other Packages Related to quantum-espresso:

dep: [libblas3]
Basic Linear Algebra Reference implementations, shared library
dep: libblas.so.3
Package not available
dep: [libc6] (>= 2.33)
GNU C Library: Shared libraries
dep: [libfftw3-double3] (>= 3.3.5)
Library for computing Fast Fourier Transforms - Double precision
dep: [libgcc-s1] (>= 4.0)
GCC support library
dep: [libgfortran5] (>= 10)
Runtime library for GNU Fortran applications
dep: [liblapack3]
Library of linear algebra routines 3 - shared version
dep: liblapack.so.3
Package not available
dep: [libopenmpi3] (>= 4.1.2)
high performance message passing library -- shared library
dep: [libscalapack-openmpi2.2] (>= 2.2.1)
Scalable Linear Algebra Package - Shared libs for OpenMPI

rec: [quantum-espresso-data]
Electronic-Structure and Ab-Initio Molecular Dynamics Suite (Documentation)

Download quantum-espresso

Architecture	Package Size	Installed Size	Files
amd64	45 MiB	274 MiB	[list of files]

Package file paths (79)

Paths come from the repository package-file index for the observed builds. They describe archive/package associations, not every file that will exist on a running system after maintainer scripts, alternatives, generated state, diversions, or installation choices.

/usr/bin/alpha2f.x
/usr/bin/average.x
/usr/bin/bands.x
/usr/bin/bse_main.x
/usr/bin/cell2ibrav.x
/usr/bin/cppp.x
/usr/bin/cp.x
/usr/bin/dos.x
/usr/bin/dvscf_q2r.x
/usr/bin/dynmat.x
/usr/bin/epa.x
/usr/bin/epsilon.x
/usr/bin/epw.x
/usr/bin/ev.x
/usr/bin/fermi_proj.x
/usr/bin/fermi_velocity.x
/usr/bin/fqha.x
/usr/bin/fs.x
/usr/bin/gww_fit.x
/usr/bin/gww.x
/usr/bin/head.x
/usr/bin/hp.x
/usr/bin/ibrav2cell.x
/usr/bin/initial_state.x
/usr/bin/kpoints.x
/usr/bin/lambda.x
/usr/bin/ld1.x
/usr/bin/manycp.x
/usr/bin/matdyn.x
/usr/bin/molecularnexafs.x
/usr/bin/molecularpdos.x
/usr/bin/neb.x
/usr/bin/open_grid.x
/usr/bin/path_interpolation.x
/usr/bin/pawplot.x
/usr/bin/phcg.x
/usr/bin/ph.x
/usr/bin/plan_avg.x
/usr/bin/plotband.x
/usr/bin/plotproj.x
/usr/bin/plotrho.x
/usr/bin/pmw.x
/usr/bin/postahc.x
/usr/bin/ppacf.x
/usr/bin/pp.x
/usr/bin/projwfc.x
/usr/bin/pw2bgw.x
/usr/bin/pw2critic.x
/usr/bin/pw2gw.x
/usr/bin/pw2wannier90.x
/usr/bin/pw4gww.x
/usr/bin/pwcond.x
/usr/bin/pwi2xsf.x
/usr/bin/pw.x
/usr/bin/q2qstar.x
/usr/bin/q2r.x
/usr/bin/scan_ibrav.x
/usr/bin/simple_bse.x
/usr/bin/simple_ip.x
/usr/bin/simple.x
/usr/bin/spectra_correction.x
/usr/bin/sumpdos.x
/usr/bin/turbo_davidson.x
/usr/bin/turbo_eels.x
/usr/bin/turbo_lanczos.x
/usr/bin/turbo_spectrum.x
/usr/bin/upfconv.x
/usr/bin/virtual_v2.x
/usr/bin/wannier_ham.x
/usr/bin/wannier_plot.x
/usr/bin/wfck2r.x
/usr/bin/wfdd.x
/usr/bin/xctest_qe_libxc.x
/usr/bin/xspectra.x
/usr/share/doc/quantum-espresso/changelog.Debian.amd64.gz
/usr/share/doc/quantum-espresso/changelog.Debian.arm64.gz
/usr/share/doc/quantum-espresso/changelog.Debian.gz
/usr/share/doc/quantum-espresso/changelog.gz
/usr/share/doc/quantum-espresso/copyright

Field source: Debian 12 (Bookworm) main amd64 revision bookworm-main-amd64:9e0b5aabb2465b3d2e7a7fe27f9913846277833f7a2826e7767acccff5b588c5

Use this package

OpenFactory can boot this operating system in a browser VM, or start a build that includes the native package name from this record.

Try Debian 12 (Bookworm) in the browser Build an image that includes quantum-espresso

Versions, suites, and repositories

Each row is recorded package-index metadata for one version, architecture, suite, and repository. Names, URLs, and sizes are source-reported; a link is a potentially mutable retrieval location, not an OpenFactory redistribution claim or proof that OpenFactory retained the artifact bytes.

Version	Release	Architecture	Repository	Package size	Installed size	Publisher repository artifact
6.7-2+b1	bookworm / main	amd64	Debian 12 · main · amd64	45 MiB	274 MiB	pool/main/e/espresso/quantum-espresso_6.7-2+b1_amd64.deb

Field source: Debian 12 (Bookworm) main amd64 revision bookworm-main-amd64:9e0b5aabb2465b3d2e7a7fe27f9913846277833f7a2826e7767acccff5b588c5

Checksums and observation dates

For an APT source, signature verification authenticates the repository metadata chain and the Packages index containing this source-reported artifact digest. It does not certify package safety.

6.7-2+b1 / amd64Observed Sep 1, 2026 to Sep 1, 2026

Verification status: Metadata observed; artifact bytes were not independently fetched or hashed by this catalog import. The digest below is source-reported.

Source-reported sha256: 368d8a8caafa07d184948f2eb8ba9b4becc324c2d3f7df64557ab81df384a8d5

After downloading that exact artifact, compare its bytes with the source-reported expected digest:

printf '%s  %s\n' '368d8a8caafa07d184948f2eb8ba9b4becc324c2d3f7df64557ab81df384a8d5' 'quantum-espresso_6.7-2+b1_amd64.deb' | sha256sum --check --strict -

A match establishes equality with the repository metadata value. It does not establish safety or catalog-side artifact retrieval.

Field source: Debian 12 (Bookworm) main amd64 revision bookworm-main-amd64:9e0b5aabb2465b3d2e7a7fe27f9913846277833f7a2826e7767acccff5b588c5

Catalog record completeness

The completeness score measures metadata coverage, not software quality, security, compatibility, or suitability.

Summary and description: 25/25
Artifact path and source digest: 25/25
Dependency metadata: 15/15
Package-file index: 15/15
Homepage: 5/5
License text: 0/5
Source package or maintainer: 10/10

Recorded total: 95/100

Field source: Debian 12 (Bookworm) main amd64 revision bookworm-main-amd64:9e0b5aabb2465b3d2e7a7fe27f9913846277833f7a2826e7767acccff5b588c5, Debian 12 (Bookworm) main arm64 revision bookworm-main-arm64:2ddb1737692e8c45c53e8d57c0ce4cd21c78c5703b830c3226b1423566a06c00. The cross-OS mapping is catalog-derived from the source-reported homepage; it does not establish authorship or publisher identity

Sources and provenance

Field-source links above resolve here. Each source entry names the metadata publisher, trust tier, exact snapshot revision, signature result, and observation time; catalog-derived mappings are labeled separately.

Debian 12 (Bookworm) main amd64Sep 1, 2026
Authoritative source; repository metadata signature verified, revision bookworm-main-amd64:9e0b5aabb2465b3d2e7a7fe27f9913846277833f7a2826e7767acccff5b588c5
Signature verification covers the configured repository metadata chain. It does not certify that the package is safe or suitable.
Repository-signature verification record
Signed object
https://deb.debian.org/debian/dists/bookworm/InRelease
Signed-object SHA-256
77737fa4b34f2693e982cc9ee35736816c35a7778fc2d326cc1bbf5b301fe1aa
Signer fingerprint
4CB50190207B4758A3F73A796ED0E7B82643E131
Keyring revision
debian-archive-keyring.gpg
SHA-256 506b815cbb32d9b6066b4a2aa524071e071761e7e7f68c3ac74f3061ba852017
Tool and policy
gpgv (GnuPG) 2.4.9
openfactory-software-catalog-signature-v1
Verification time
Sep 1, 2026
Signed Release → package-index hash linkage
Path: main/binary-amd64/Packages.xz
Expected SHA-256: 9e0b5aabb2465b3d2e7a7fe27f9913846277833f7a2826e7767acccff5b588c5
Observed SHA-256: 9e0b5aabb2465b3d2e7a7fe27f9913846277833f7a2826e7767acccff5b588c5
Result: match verified
Debian 12 (Bookworm) main arm64Sep 1, 2026
Authoritative source; repository metadata signature verified, revision bookworm-main-arm64:2ddb1737692e8c45c53e8d57c0ce4cd21c78c5703b830c3226b1423566a06c00
Signature verification covers the configured repository metadata chain. It does not certify that the package is safe or suitable.
Repository-signature verification record
Signed object
https://deb.debian.org/debian/dists/bookworm/InRelease
Signed-object SHA-256
77737fa4b34f2693e982cc9ee35736816c35a7778fc2d326cc1bbf5b301fe1aa
Signer fingerprint
4CB50190207B4758A3F73A796ED0E7B82643E131
Keyring revision
debian-archive-keyring.gpg
SHA-256 506b815cbb32d9b6066b4a2aa524071e071761e7e7f68c3ac74f3061ba852017
Tool and policy
gpgv (GnuPG) 2.4.9
openfactory-software-catalog-signature-v1
Verification time
Sep 1, 2026
Signed Release → package-index hash linkage
Path: main/binary-arm64/Packages.xz
Expected SHA-256: 2ddb1737692e8c45c53e8d57c0ce4cd21c78c5703b830c3226b1423566a06c00
Observed SHA-256: 2ddb1737692e8c45c53e8d57c0ce4cd21c78c5703b830c3226b1423566a06c00
Result: match verified