Prasanta Kumar Nandi
Area:Molecular Electronic Structure and Spectroscopic Properties, Computational Chemistry
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|Roy RS, Nandi PK. (2018) Electronic structure and large second-order non-linear optical property of COT derivatives - a theoretical exploration. Physical Chemistry Chemical Physics : Pccp|
|Mondal A, Hatua K, Roy RS, et al. (2017) Successive lithiation of acetylene, ethylene and benzene: a comprehensive computational study of large static second hyperpolarizability. Physical Chemistry Chemical Physics : Pccp|
|Hatua K, Nandi PK. (2015) Second hyperpolarizability of delta shaped disubstituted acetylene complexes of beryllium, magnesium, and calcium. Journal of Molecular Modeling. 21: 254|
|Hatua K, Nandi PK. (2013) Beryllium-cyclobutadiene multidecker inverse sandwiches: electronic structure and second-hyperpolarizability. The Journal of Physical Chemistry. A. 117: 12581-9|
|Nandi PK, Panja N, Ghanty TK, et al. (2009) Theoretical study of the effect of structural modifications on the hyperpolarizabilities of indigo derivatives. The Journal of Physical Chemistry. A. 113: 2623-31|
|Nandi PK, Panja N, Ghanty TK. (2008) Heterocycle-based isomeric chromophores with substantially varying NLO properties: a new structure-property correlation study. The Journal of Physical Chemistry. A. 112: 4844-52|
|Kar T, Panja N, Nandi PK. (2006) Electronic structure and spectroscopic properties of the two structural isomers of donor-acceptor substituted sesquifulvalene in the gas and solution phases-a case study of sudden polarization. The Journal of Physical Chemistry. A. 110: 12684-92|