Dear Sir, I want to understand the background mathematics/solving process of QE, for example, how QE solves a simple vc-relax with a simplest atom when I change one pseudopotential type to another?. Or how it transforms the Schrodinger's and Poisson's equation into set of linear algebra? Can you suggest me which file I should be looking into?
With regards ********************************************** Sitangshu Bhattacharya (সিতাংশু ভট্টাচার্য), Ph.D Assistant Professor, Room No. 2221, CC-1, Nanoscale Electro-Thermal Laboratory, Department of Electrical and Communication Engineering, Indian Institute of Information Technology-Allahabad Uttar Pradesh 211 012 India Telephone: 91-532-2922000 Extn.: 2131 Web-page: http://profile.iiita.ac.in/sitangshu/ Institute: http://www.iiita.ac.in/
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