Personal information

India

Activities

Employment (1)

Scott Christian College: Nagercoil, Tamil Nadu, IN

1998-07-17 to present | Associate Professor (Physics)
Employment
Source: Self-asserted source
James C.

Education and qualifications (1)

Scott Christian College (Autonomous): Nagercoil, Tamilnadu, IN

1998-07-17 to present | PhD (Physics)
Education
Source: Self-asserted source
James C.

Works (23)

Quantum chemical insight into molecular structure, density functional theory calculations, vibrational dynamics, natural population analysis, Hirshfeld analysis, and molecular docking approach to chalcone 1-4-bromophenyl-3-(2-methoxyphenyl)prop-2-en-1-one

Spectroscopy Letters
2018 | Journal article
EID:

2-s2.0-85044232745

Contributors: Rachelin, Y.P.; Pradhan, S.; James, C.
Source: Self-asserted source
James C. via Scopus - Elsevier

Study on growth, electronic structure, topological and nonlinear optical properties of semi organic material sodium sulfanilate dehydrate

Journal of Materials Science: Materials in Electronics
2018 | Journal article
EID:

2-s2.0-85052646139

Contributors: Arun Sasi, B.S.; Alen, S.; Joy, L.K.; Sajan, D.; James, C.
Source: Self-asserted source
James C. via Scopus - Elsevier

Characteristics of the molecular electron density, delocalization effect and hydrogen bonding interaction of nitroxoline

Journal of Molecular Structure
2017 | Journal article
EID:

2-s2.0-85017305039

Contributors: Arun Sasi, B.S.; Twinkle, A.R.; James, C.
Source: Self-asserted source
James C. via Scopus - Elsevier

Perspective on quantifying electron localization/delocalization, non-linear optical response and vibrational analysis of 4-(dimethylamino)benzaldehyde-2,4-dinitroaniline

Journal of Molecular Structure
2017 | Journal article
EID:

2-s2.0-85020877710

Contributors: Arun Sasi, B.S.; Jebin, R.P.; Suthan, T.; James, C.
Source: Self-asserted source
James C. via Scopus - Elsevier

Vibrational spectral characterization, NLO studies and charge transfer analysis of the organometallic material l-Alanine cadmium chloride

Journal of Molecular Structure
2016 | Journal article
EID:

2-s2.0-84945161559

Contributors: Arun Sasi, B.S.; Bright, K.C.; James, C.
Source: Self-asserted source
James C. via Scopus - Elsevier

FT-Raman and FTIR spectra, DFT investigation of the structure and vibrational assignment of mefenacet

Journal of Molecular Structure
2015 | Journal article
EID:

2-s2.0-84928496137

Contributors: Clemy Monicka, J.; James, C.
Source: Self-asserted source
James C. via Scopus - Elsevier

DFT-assisted spectroscopic characterization of pyrazosulfuron-ethyl: FT-Raman, FTIR and UV-vis studies of a sulfonyl urea herbicide

Journal of Molecular Structure
2014 | Journal article
EID:

2-s2.0-84904878795

Contributors: Monicka, J.C.; James, C.
Source: Self-asserted source
James C. via Scopus - Elsevier

FT IR, FT-Raman spectra and chemical computations of herbicide 2-phenoxy propionic acid - A DFT approach

Spectrochimica Acta - Part A: Molecular and Biomolecular Spectroscopy
2014 | Journal article
EID:

2-s2.0-84890491219

Contributors: Joselin Beaula, T.; James, C.
Source: Self-asserted source
James C. via Scopus - Elsevier

Electronic structure investigations and spectroscopic studies on the herbicidal molecule 4-Nitro phenyl-phenylether

Journal of Molecular Structure
2013 | Journal article
EID:

2-s2.0-84867740270

Contributors: Premila Rachelin, Y.; Nair, L.P.; James, C.
Source: Self-asserted source
James C. via Scopus - Elsevier

Molecular modeling and spectral comparison for the change in methyl position of nitrophenol compounds 2-methyl-4-nitrophenol and 3-methyl-4-nitrophenol: A density functional theoretical study

Spectrochimica Acta - Part A: Molecular and Biomolecular Spectroscopy
2013 | Journal article
EID:

2-s2.0-84873744523

Contributors: Siva Priya, M.; Usha Rani, N.; James, C.
Source: Self-asserted source
James C. via Scopus - Elsevier

Quantum chemical computations including intermolecular interactions, natural bond orbital analysis and scaled quantum mechanical force field calculations on bezafibrate - A cholesterol drug for HIV infected

Vibrational Spectroscopy
2012 | Journal article
EID:

2-s2.0-84857918754

Contributors: Chithra, N.K.; James, C.
Source: Self-asserted source
James C. via Scopus - Elsevier

Theoretical and experimental vibrational study of the phenyl urea herbicide 1-(4-bromo-3-chlorophenyl)-3-methoxy-3-methylurea

Spectrochimica Acta - Part A: Molecular and Biomolecular Spectroscopy
2012 | Journal article
EID:

2-s2.0-84861837697

Contributors: Monicka, J.C.; James, C.
Source: Self-asserted source
James C. via Scopus - Elsevier

Vibrational spectra and natural bond orbital analysis of the herbicidal molecule 2(4-chlorophenoxy)-2-methyl propionic acid

Spectrochimica Acta - Part A: Molecular and Biomolecular Spectroscopy
2011 | Journal article
EID:

2-s2.0-79151468925

Contributors: Monicka, J.C.; James, C.
Source: Self-asserted source
James C. via Scopus - Elsevier

Vibrational spectroscopic investigation and normal coordinate analysis of the fibrate hypolipidemic agent 5-(2,5-dimethylphenoxy)-2,2-dimethyl pentanoic acid (gemfibrozil)

Journal of Molecular Structure
2011 | Journal article
EID:

2-s2.0-79952314410

Contributors: Priya, M.S.; Benitta, T.A.; James, C.
Source: Self-asserted source
James C. via Scopus - Elsevier

Vibrational spectra and potential energy distributions for 1-benzyl-1H-imidazole by normal coordinate analysis

Journal of Raman Spectroscopy
2009 | Journal article
EID:

2-s2.0-67649382237

Contributors: James, C.; Ravikumar, C.; Jayakumar, V.S.; Joe, I.H.
Source: Self-asserted source
James C. via Scopus - Elsevier

Analysis of vibrational spectra of l-alanylglycine based on density functional theory calculations

Spectrochimica Acta - Part A: Molecular and Biomolecular Spectroscopy
2008 | Journal article
EID:

2-s2.0-49849105091

Contributors: Padmaja, L.; Ravikumar, C.; James, C.; Jayakumar, V.S.; Hubert Joe, I.
Source: Self-asserted source
James C. via Scopus - Elsevier

FT-Raman and FTIR spectra, normal coordinate analysis and ab initio computations of (2-methylphenoxy)acetic acid dimer

Vibrational Spectroscopy
2008 | Journal article
EID:

2-s2.0-42049092550

Contributors: James, C.; Ravikumar, C.; Sundius, T.; Krishnakumar, V.; Kesavamoorthy, R.; Jayakumar, V.S.; Hubert Joe, I.
Source: Self-asserted source
James C. via Scopus - Elsevier

Vibrational spectra and ab initio molecular orbital calculations of the novel anti-cancer drug combretastatin A-4 prodrug

Spectrochimica Acta - Part A: Molecular and Biomolecular Spectroscopy
2008 | Journal article
EID:

2-s2.0-48949094045

Contributors: James, C.; Pettit, G.R.; Nielsen, O.F.; Jayakumar, V.S.; Joe, I.H.
Source: Self-asserted source
James C. via Scopus - Elsevier

Vibrational spectral simulation of 1-Benzyl-1 H -Imidazole using scaled DFT force fields

AIP Conference Proceedings
2008 | Conference paper
EID:

2-s2.0-85037858742

Contributors: James, C.; Ravikumar, C.; Jayakumar, V.S.; Joe, I.H.
Source: Self-asserted source
James C. via Scopus - Elsevier

Vibrational spectral studies of gemfibrozil

AIP Conference Proceedings
2008 | Conference paper
EID:

2-s2.0-85037857383

Contributors: Benitta, T.A.; Balendiran, G.K.; James, C.
Source: Self-asserted source
James C. via Scopus - Elsevier

Natural bond orbital analysis and vibrational spectroscopic studies of H-bonded N,N′-diphenylguanidinium nitrate

Journal of Molecular Structure
2007 | Journal article
EID:

2-s2.0-33846819060

Contributors: James, C.; Jayakumar, V.S.; Hubert Joe, I.
Source: Self-asserted source
James C. via Scopus - Elsevier

Structural conformation and vibrational spectroscopic studies of 2,6-bis(p-N,N-dimethyl benzylidene) cyclohexanone using density functional theory

Journal of Raman Spectroscopy
2006 | Journal article
EID:

2-s2.0-33845985942

Contributors: James, C.; Raj, A.A.; Reghunathan, R.; Jayakumar, V.S.; Joe, I.H.
Source: Self-asserted source
James C. via Scopus - Elsevier

Vibrational analysis and Y-aromaticity in bis (N,N′-diphenyl guanidinium) oxalate crystal: A DFT study

Journal of Molecular Structure
2006 | Journal article
EID:

2-s2.0-33144489353

Contributors: Binoy, J.; James, C.; Hubert Joe, I.; Jayakumar, V.S.
Source: Self-asserted source
James C. via Scopus - Elsevier