Raman, FT-IR spectroscopic analysis and first-order hyperpolarisability of 3-benzoyl-5-chlorouracil by first principles

Molecular Simulation - Tập 37 Số 2 - Trang 153-163 - 2011
Leena Sinha1, Onkar Prasad1, Vijay Narayan1, S. R. Shukla2
1Physics Department, University of Lucknow, Lucknow 226007, India
2Institute of Wood Sciences and Technology , Bangalore , 560003 , India

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