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11. On-the-fly ab intito calculations of anharmonic vibrational frequencies: local-monomer theory and application to HCl clusters. Mancini JS; Bowman JM J Chem Phys; 2013 Oct; 139(16):164115. PubMed ID: 24182012 [TBL] [Abstract][Full Text] [Related]
12. Erratum: "Communication: Symmetry-adapted perturbation theory with intermolecular induction and dispersion energies from the Bethe-Salpeter equation" [J. Chem. Phys. 147, 181101 (2017)]. Holzer C; Klopper W J Chem Phys; 2018 Jan; 148(1):019901. PubMed ID: 29306290 [No Abstract] [Full Text] [Related]
13. Understanding the role of vibrations, exact exchange, and many-body van der Waals interactions in the cohesive properties of molecular crystals. Reilly AM; Tkatchenko A J Chem Phys; 2013 Jul; 139(2):024705. PubMed ID: 23862957 [TBL] [Abstract][Full Text] [Related]
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17. Density-functional theory study of vibrational relaxation of CO stretching excitation on Si(100). Sakong S; Kratzer P; Han X; Lass K; Weingart O; Hasselbrink E J Chem Phys; 2008 Nov; 129(17):174702. PubMed ID: 19045365 [TBL] [Abstract][Full Text] [Related]
18. Exploring Anharmonic Nuclear Dynamics and Spectroscopy Using the Kratzer Oscillator. Toutounji M J Chem Theory Comput; 2011 Jun; 7(6):1804-13. PubMed ID: 26596443 [TBL] [Abstract][Full Text] [Related]
19. Complexes of type C6H7(+)·L (L = N2 and CO2) studied by explicitly correlated coupled cluster theory. Botschwina P; Oswald R J Chem Phys; 2012 May; 136(20):204301. PubMed ID: 22667554 [TBL] [Abstract][Full Text] [Related]
20. Comment on "Comment on 'Constant temperature molecular dynamics simulations by means of a stochastic collision model. II. The harmonic oscillator' [J. Chem. Phys. 104, 3732 (1996)]" [J. Chem. Phys. 106, 1646 (1997)]. Kast SM J Chem Phys; 2004 Mar; 120(10):4991-2. PubMed ID: 15267362 [TBL] [Abstract][Full Text] [Related] [Next] [New Search]