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A variationally computed T = 300 K line list for NH3.
Yurchenko SN, Barber RJ, Yachmenev A, Thiel W, Jensen P, Tennyson J. Yurchenko SN, et al. Among authors: jensen p. J Phys Chem A. 2009 Oct 29;113(43):11845-55. doi: 10.1021/jp9029425. J Phys Chem A. 2009. PMID: 19634882
Radiative cooling of H3O+ and its deuterated isotopologues.
Melnikov VV, Yurchenko SN, Tennyson J, Jensen P. Melnikov VV, et al. Among authors: jensen p. Phys Chem Chem Phys. 2016 Sep 21;18(37):26268-26274. doi: 10.1039/c6cp04661d. Phys Chem Chem Phys. 2016. PMID: 27711706 Free PMC article.
Theoretical rotation-torsion spectra of HSOH.
Yachmenev A, Yurchenko SN, Jensen P, Baum O, Giesen TF, Thiel W. Yachmenev A, et al. Among authors: jensen p. Phys Chem Chem Phys. 2010 Aug 1;12(29):8387-97. doi: 10.1039/c002803g. Epub 2010 Jun 5. Phys Chem Chem Phys. 2010. PMID: 20526504
A new "spectroscopic" potential energy surface for formaldehyde in its ground electronic state.
Yachmenev A, Yurchenko SN, Jensen P, Thiel W. Yachmenev A, et al. Among authors: jensen p. J Chem Phys. 2011 Jun 28;134(24):244307. doi: 10.1063/1.3599927. J Chem Phys. 2011. PMID: 21721630
Ro-vibrational energies of formaldehyde were determined variationally for this ab initio PES by means of the program TROVE [Theoretical ROtation-Vibration Energies; S. N. Yurchenko, W. Thiel, and P. Jensen, J. Mol. Spectrosc. 245, 126 (2007)]. The parameter values i …
Ro-vibrational energies of formaldehyde were determined variationally for this ab initio PES by means of the program TROVE [Theoretical ROta …
3,467 results