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go back to [[Main Page]], [[Chemistry & More]] | go back to [[Main Page]], [[Chemistry & More]] | ||
*''' List of very useful papers ''' | *''' List of very useful papers ''' | ||
Revision as of 10:56, 12 June 2009
go back to Main Page, Chemistry & More
- List of very useful papers
Fundamentals of Plane Wave calculations: [1] Test on functionals: [2] CI-NEB: d-band model: [3] Universality and related concepts: [4] [5] [6] Bayesian: [7]
- Interesting review on the accuracy of quantum chemical methods.File:A priori calculation molecular properties-Helgaker-04.pdf
- d and f polarization function basis sets by Frenking and coworkers. File:1993-CPL-208-237.pdf, File:1993-CPL-208-111.pdf, and a correction File:1994-CPL-224-603.pdf