Multimode calculations of rovibrational energies of C2H4and C2D4
Author:
Publisher
Informa UK Limited
Subject
Physical and Theoretical Chemistry,Condensed Matter Physics,Molecular Biology,Biophysics
Link
http://www.tandfonline.com/doi/pdf/10.1080/00268976.2012.669504
Reference29 articles.
1. Variational quantum approaches for computing vibrational energies of polyatomic molecules
2. The fourth age of quantum chemistry: molecules in motion
3. Using a pruned basis, a non-product quadrature grid, and the exact Watson normal-coordinate kinetic energy operator to solve the vibrational Schrödinger equation for C2H4
4. The anharmonic force field of ethylene, C2H4, by means of accurate ab initio calculations
5. MULTIMODE: A code to calculate rovibrational energies of polyatomic molecules
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