The equilibrium structure and harmonic vibrational frequencies of ozone: Coupled cluster results including triple excitations
Author:
Publisher
AIP Publishing
Subject
Physical and Theoretical Chemistry,General Physics and Astronomy
Link
http://aip.scitation.org/doi/pdf/10.1063/1.457053
Reference20 articles.
1. Highly correlated single‐reference studies of the O3 potential surface. I. Effects of high order excitations on the equilibrium structure and harmonic force field of ozone
2. One-electron property from MCHF wavefunction: the dipole moment of ozone
3. One-electron property from MCHF wavefunction: the dipole moment of ozone
4. Towards a full CCSDT model for electron correlation
5. A study of Be2with many‐body perturbation theory and a coupled‐cluster method including triple excitations
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