Low-level DFT calculations II: molecules containing fluorine and second-row atoms
Author:
Publisher
Elsevier BV
Subject
Physical and Theoretical Chemistry,Condensed Matter Physics,Biochemistry
Reference52 articles.
1. Gaussian‐2 theory for molecular energies of first‐ and second‐row compounds
2. Gaussian‐2 theory using reduced Mo/ller–Plesset orders
3. A complete basis set model chemistry. V. Extensions to six or more heavy atoms
4. A complete basis set model chemistry. IV. An improved atomic pair natural orbital method
5. A complete basis set model chemistry. III. The complete basis set‐quadratic configuration interaction family of methods
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