Day 2: Density-functional practice
- Owner: Roberto Bendinelli
- Created on Jan 12, 2023
- Access: Public (Space Default)
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Description:
An introduction to calculations using the total energy, planewaves, pseudopotential method. Suitable for everyone that wants to learn how to perform a DFT calculation. A self-learning handout and a virtual machine with pre-installed open-source quantum-simulation codes are also available - we'll use Quantum ESPRESSO. (Note: annotated slides are not available.)
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Extracted by http://clowder.ncsa.illinois.edu/extractors/deprecatedapi on Mar 28, 2025 | |
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Extracted by http://clowder.ncsa.illinois.edu/extractors/deprecatedapi on Mar 28, 2025 |
Extracted by
http://clowder.ncsa.illinois.edu/extractors/deprecatedapi
on Mar 28, 2025
- key: ds_order
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Extracted by
http://clowder.ncsa.illinois.edu/extractors/deprecatedapi
on Mar 28, 2025
- key: ds_order
- value: 1
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