Author:
Krishnakumar V.,Xavier R. John,Chithambarathanu T.
Subject
Spectroscopy,Instrumentation,Atomic and Molecular Physics, and Optics,Analytical Chemistry
Reference44 articles.
1. For excellent reviews of DFT and its applications, see (a) R.G. Parr, W. Yang, Density Functional Theory of Atoms and Molecules, Oxford, New York, 1989. (b) R.O. Jones, O. Gunnarson, Rev. Mol. Phys. 61 (1989) 689. (c) T. Ziegler, Chem. Rev. 91 (1991) 651.
2. Self-Consistent Equations Including Exchange and Correlation Effects
3. Density functional study of a highly correlated molecule, oxygen fluoride (FOOF)
4. Nitrosyl hypofluorite: local density functional study of a problem case for theoretical methods
5. Structures and vibrational frequencies of FOOF and FONO using density functional theory
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