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- VASP - Vienna Ab initio Simulation Package
In-person VASP workshop: Introduction to advanced techniques Interested in personal tutoring by VASP developers? Registration for our in-person workshop in Rennes, France! Attend this workshop (June 30 - July 04, 2025) to get a wide-ranging introduction and master the latest features concerning electron-phonon coupling, magnetism, and more
- Tutorials - VASP Wiki
The VASP Wiki is the user manual for VASP Also, check out the documentation of py4vasp Meet the VASP Community in the VASP Forum! Here, you can ask questions to other users and get technical support from the VASP Team Go to top
- Learn - VASP Wiki
Tutorials New to VASP? With our detailed tutorials you can learn to run your VASP calculations
- Info
Contact If you want to license VASP, please contact licensing@vasp at For other inquiries, please check our contact page
- Part 1: Introduction to VASP
VASP looks in the current directory for four main input files, i e , POSCAR, INCAR, KPOINTS and POTCAR The general format of each input file is explained in details in the linked articles that lead to the VASP Wiki, but below we will discuss the particular choices for this example
- Part 1: Basic transition states - VASP Wiki
Calculate the reaction pathway using nudged elastic band with 4 images for the self-diffusion of a Si atom to a vacancy site in a 15-atom Si primitive supercell All chemical reactions go from reactant to product via a transition state One approach for modeling transition states is the nudged elastic band (NEB) method [J Chem Phys 113, 9978 (2000)] NEB takes the reactant and product
- News - VASP Wiki
We invite you to participate in the first VASP workshop of the year, three days on nuclei and core electrons in VASP - Getting close to the nucleus You will be introduced to VASP and PAWs, before learning more advanced techniques like how to model nuclear magnetic resonance (NMR) and X-ray absorption spectroscopy (XAS)
- Resources - VASP Wiki
Resources Commercial Resources materials design An industrially supported, compiled, and tested form of VASP is part of Materials Design’s MedeA software environment Integrated with the world’s leading structural databases, MedeA offers VASP users a comprehensive software platform for large-scale computational materials science and
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