https://cppaw.org/
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https://cppaw.org/
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This block course introduces international students to the state-of-the-art of modern electronic-structure calculations. The course provides the theoretical background on methods and materials as well as a hands-on practical course on the CP-PAW code. The course targets physicists and chemists during their masters or early PhD studies.text/html2025-05-12T13:25:25+00:00Anonymous (anonymous@undisclosed.example.com)sidebar
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Code package
* CPPAW Home
* Download
* Installation
* Resources
* Testing
* FAQ
Hands-on course
* Course webpage
* Course Material
* Reminiscenses
* Evaluationstext/html2024-04-27T09:41:09+00:00Anonymous (anonymous@undisclosed.example.com)start
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CP-PAW Home
The Projector Augmented Wave (PAW) method is an algorithm developed by Peter Blöchl for the quantum mechanical simulation of electrons in materials and molecules. The CP-PAW code is the first implementation of the PAW method.
CP-PAW code relies heavily on the ab-initio molecular dynamics (AIMD) framework invented by Roberto Car and Michele Parrinello (CP). The first two letters of the name of the code are a tribute to their contribution. The PAW method has been developed to over…