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Sambhu Nath Datta
Sambhu Nath Datta
Professor Emeritus, Department of Chemistry, Indian Institute of Technology Bombay
Adresse e-mail validée de chem.iitb.ac.in - Page d'accueil
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Broken-symmetry density functional theory investigation on bis-nitronyl nitroxide diradicals: influence of length and aromaticity of couplers
ME Ali, SN Datta
The Journal of Physical Chemistry A 110 (8), 2776-2784, 2006
1512006
Phenylene Coupling of Methylene Sites. The Spin States of Bis(X−methylene)-p-phenylenes and Bis(chloromethylene)-m-phenylene
C Trindle, SN Datta, B Mallik
Journal of the American Chemical Society 119 (52), 12947-12951, 1997
1031997
Molecular orbital studies on the spin states of nitroxide species: Bis‐and trisnitroxymetaphenylene, 1, 1‐bisnitroxyphenylethylene, and 4, 6‐dimethoxy‐1, 3‐dialkylnitroxy‐benzenes
C Trindle, S Nath Datta
International journal of quantum chemistry 57 (4), 781-799, 1996
871996
The Triplet–Singlet Gap in the m-Xylylene Radical: A Not So Simple One
D Reta Mañeru, AK Pal, IPR Moreira, SN Datta, F Illas
Journal of Chemical Theory and Computation 10 (1), 335-345, 2014
672014
The minimax technique in relativistic Hartree-Fock calculations
SN Datta, G Devaiah
Pramana 30, 387-405, 1988
641988
Theoretical determination of the standard reduction potential of plastocyanin in vitro
SN Datta, J Sudhamsu, A Pandey
The Journal of Physical Chemistry B 108 (23), 8007-8016, 2004
562004
Theoretical and computational aspects of magnetic organic molecules
SN Datta, CO Trindle, F Illas
World Scientific, 2013
552013
Theoretical and computational aspects of magnetic organic molecules
SN Datta, CO Trindle, F Illas
World Scientific, 2013
552013
Theoretical and computational aspects of magnetic organic molecules
SN Datta, CO Trindle, F Illas
World Scientific, 2013
552013
Theoretical and computational aspects of magnetic organic molecules
SN Datta, CO Trindle, F Illas
World Scientific, 2013
552013
Theoretical and computational aspects of magnetic organic molecules
SN Datta, CO Trindle, F Illas
World Scientific, 2013
552013
Theoretical and computational aspects of magnetic organic molecules
SN Datta, CO Trindle, F Illas
World Scientific, 2013
552013
Theoretical and computational aspects of magnetic organic molecules
SN Datta, CO Trindle, F Illas
World Scientific, 2013
552013
Theoretical and computational aspects of magnetic organic molecules
SN Datta, CO Trindle, F Illas
World Scientific, 2013
552013
Theoretical and computational aspects of magnetic organic molecules
SN Datta, CO Trindle, F Illas
World Scientific, 2013
552013
Theoretical and computational aspects of magnetic organic molecules
SN Datta, CO Trindle, F Illas
World Scientific, 2013
552013
Theoretical and computational aspects of magnetic organic molecules
SN Datta, CO Trindle, F Illas
World Scientific, 2013
552013
Polyacene spacers in intramolecular magnetic coupling
ME Ali, SN Datta
The Journal of Physical Chemistry A 110 (49), 13232-13237, 2006
552006
Application of effective potentials to relativistic hartree—fock calculations
SN Datta, CS Ewig, JR Van Wazer
Chemical Physics Letters 57 (1), 83-89, 1978
511978
Molecular tailoring and prediction of strongly ferromagnetically coupled trimethylenemethane-based nitroxide diradicals
ME Ali, AS Roy, SN Datta
The Journal of Physical Chemistry A 111 (25), 5523-5527, 2007
462007
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