Lalitha Selvam - Publications
Affiliations: | Centre for Molecular Simulation | Swinburne University of Technology, Australia |
Year | Citation | Score | |||
---|---|---|---|---|---|
2012 | Wang F, Ma XG, Selvam L, Gribakin GF, Surko CM. Chemical structural effects on γ-ray spectra of positron annihilation in fluorobenzenes The European Physical Journal D. 66. DOI: 10.1140/Epjd/E2012-20741-1 | 0.486 | |||
2012 | Wang F, Ma X, Selvam L, Gribakin G, Surko CM. Effects of quantum chemistry models for bound electrons on positron annihilation spectra for atoms and small molecules New Journal of Physics. 14: 085022. DOI: 10.1088/1367-2630/14/8/085022 | 0.454 | |||
2011 | Selvam L, Chen FF, Wang F. Methylation of zebularine investigated using density functional theory calculations. Journal of Computational Chemistry. 32: 2077-83. PMID 21541952 DOI: 10.1002/Jcc.21785 | 0.396 | |||
2010 | Wang F, Selvam L, Gribakin GF, Surko CM. Electron shell contributions to gamma-ray spectra of positron annihilation in noble gases Journal of Physics B: Atomic, Molecular and Optical Physics. 43: 165207. DOI: 10.1088/0953-4075/43/16/165207 | 0.396 | |||
2010 | Selvam L, Chen F, Wang F. Solvent effects on blue shifted improper hydrogen bond of C–H⋯O in deoxycytidine isomers Chemical Physics Letters. 500: 327-333. DOI: 10.1016/J.Cplett.2010.10.033 | 0.48 | |||
2010 | Chen F, Selvam L, Wang F. Blue shifted intramolecular C−H···O improper hydrogen bonds in conformers of zidovudine Chemical Physics Letters. 493: 358-363. DOI: 10.1016/J.Cplett.2010.05.057 | 0.485 | |||
2009 | Selvam L, Vasilyev V, Wang F. Methylation of zebularine: a quantum mechanical study incorporating interactive 3D pdf graphs. The Journal of Physical Chemistry. B. 113: 11496-504. PMID 19637931 DOI: 10.1021/Jp901678G | 0.373 | |||
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