M. Amalanathan

Study on conformational stability, molecular structure, vibrational spectra, NBO, TD-DFT, HOMO and LUMO analysis of 3,5-dinitrosalicylic acid by DFT techniques

S. Sebastian, S. Sylvestre, Jayaraman Jayabharathi et al. · Spectrochimica Acta Part A Molecular and Biomolecular Spectroscopy · 2014 · 45 citations

Dft Techniques, Engineering, Biochemistry +8

Molecular structure and charge transfer contributions to nonlinear optical property of 2-Methyl-4-nitroaniline: A DFT study

G. Femina Jasmine, M. Amalanathan, S.D.D. Roy · Journal of Molecular Structure · 2016 · 33 citations

Engineering, Physics, Nonlinear Optics +11

Charge Transfer Interaction and Terahertz Studies of a Nonlinear Optical Material <scp>l</scp>-Glutamine Picrate: A DFT Study

M. Amalanathan, I. Hubert Joe, S. S. Prabhu · The Journal of Physical Chemistry A · 2010 · 32 citations

Optical Materials, Engineering, Nonlinear Optics +29

Vibrational spectra (FT-IR and FT-Raman), molecular structure, natural bond orbital, and TD-DFT analysis of l-Asparagine Monohydrate by Density Functional Theory approach

S. Sylvestre, S. Sebastian, S. Edwin et al. · Spectrochimica Acta Part A Molecular and Biomolecular Spectroscopy · 2014 · 26 citations

Td-dft Analysis, Molecular Spectroscopy, Physicochemical Analysis +5

Molecular structure and vibrational spectral investigation of charge transfer NLO crystal Naphthalene Picrate for THz application

M. Amalanathan, I. Hubert Joe, V. K. Rastogi · Spectrochimica Acta Part A Molecular and Biomolecular Spectroscopy · 2013 · 23 citations

Organic Charge-transfer Compound, Thz Photonics, Terahertz Spectroscopy +8