Accurate equilibrium inversion barrier of ammonia by extrapolation to the one-electron basis set limit
Author:
Publisher
IOP Publishing
Subject
General Physics and Astronomy
Link
https://iopscience.iop.org/article/10.1088/1674-1056/23/2/023301/pdf
Reference42 articles.
1. The vibrational levels of ammonia
2. Inversion barriers by the MINDO [modified intermediate neglect of differential overlap] method
3. Electronic Structure and Inversion Barrier of Ammonia
4. Ab initio calculation of the equilibrium geometry of NH+4 and NH3 and the symmetric stretching potential of NH+4
5. Anharmonic potential function and effective geometries for the NH3 molecule
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