Energy vs volume Volume relaxations and Pulay stress: Revision history

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  • curprev 12:1512:15, 24 July 2018Kaltakm talk contribs 3,536 bytes +3,536 Created page with "If you are doing energy-volume calculations or cell shape and volume relaxations you must understand the Pulay stress, and related problems. The Pulay stress arises from the..."