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Introduction
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Classroom Contents
Electronic-Structure Methods for Materials Science - Advanced Quantum ESPRESSO Tutorial
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- 1 Introduction
- 2 Welcome
- 3 First principle simulation
- 4 Novel materials
- 5 Density functional theory
- 6 Onetoone correspondence
- 7 Connection potential
- 8 Weaknesses of existential theory
- 9 Dissociation
- 10 Schrodinger equation
- 11 Piecewise linearity
- 12 Harvard corrections
- 13 Quantum chemistry
- 14 Selfinteraction
- 15 Linearity problem
- 16 Hybrids
- 17 Summary
- 18 Conclusion
- 19 Cook monster
