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NEW RELEASE: VASP.6.6.1
Guidelines on the Use of AI Tools in Connection with VASP Software
Functionals
Structure relaxation
Molecular dynamics
Magnetism
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Contents

NEW RELEASE: VASP.6.6.1

Guidelines on the Use of AI Tools in Connection with VASP Software

Structure relaxation

Molecular dynamics

About

Green's function methods
Many-body perturbation theory
First derivatives
Linear response to ionic displacements
Linear response to electric fields

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How can I purchase a VASP license?
Optical properties
Berry phases
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phonopy
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Job announcement: Open position
VASP Workshop at IIT Bombay, Mumbai (2026)
NEW RELEASE: VASP.6.6.0
Beyond the single particle - strongly correlated systems
VASP website maintenance finished
Electron-phonon interactions in VASP
NEW RELEASE: VASP.6.5.1
VASP - Getting close to the nucleus
NEW RELEASE: VASP.6.5.0
In-person VASP workshop: Introduction to advanced techniques
Job opportunity: Python developer / data scientist
Exploring chemical reactions in VASP
Online VASP workshop: From setup to solution—getting started with VASP
NEW RELEASE: VASP.6.4.3
Online VASP workshop: Advanced optics and dielectric properties
Job announcement: Two open positions.
VASP support extension for Visual Studio Code
NEW RELEASE: VASP.6.4.2
Online VASP workshop: Moving ions for the advanced user
NEW RELEASE: VASP.6.4.1
NEW RELEASE: VASP.6.4.0
Offer to VASP.5 users: Upgrade to VASP.6
NEW RELEASE: VASP.6.3.2
Online VASP workshop: Electronic correlation from first principles
Research Software Engineers
Online VASP workshop: Moving ions with VASP
NEW RELEASE: VASP.6.3.1
py4vasp available via PyPI
NEW RELEASE: VASP.6.3.0
1st online VASP workshop: Introduction to ab-initio simulation
NEW RELEASE: VASP.6.2.1
NEW RELEASE: VASP.6.2.0
Bugfix: testsuite in VASP.6.1.0 to 6.1.2 on MacOS and BSD
Important Notice CoViD-19
NEW RELEASE: VASP.6.1.0
VASP Forum login problems
VASP site migration finished
VASP site migration
Bugfix: patch #1 for vasp.5.4.4.18Apr17
NEW RELEASE: VASP.5.4.4
NEW RELEASE: PAW datasets v.54!
Hybrid improper Ferroelectricity
NEW RELEASE: VASP.5.3.3
NEW RELEASE: P4VASP 0.3.23
Bugfix: in vdwforcefield.F
Bugfix: VASP.5.2.11 on IBM
Bugfix: in VASP.5.2.11
Bugfix: in VASP.5.2.11
Bugfix: in VASP.5.2.11
A multiferroic material to search for the permanent electric dipole moment of the electron
ACFDT total energies in the RPA
GW quasiparticle energies
HSE hybrid functional
Linear response in the PAW
PBE0 hybrid functional
PAW paper II
VASP methodology paper II
VASP methodology paper I
PAW paper I

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ACFDT total energies in the RPA

Accurate Bulk Properties from Approximate Many-Body Techniques Judith Harl and Georg Kresse

Phys. Rev. Lett. 103, 056401 (2009)

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