Raman K. Singh

Publication Activity (10 Years)

Years Active: 2013-2018
Publications (10 Years): 4

Top Topics

Energy Minimization

Rigid And Non Rigid

Top Venues

J. Comput. Chem.

Publications

Raman K. Singh, Takeshi Iwasa, Tetsuya Taketsugu
Insights into geometries, stabilities, electronic structures, reactivity descriptors, and magnetic properties of bimetallic NimCun-m (m = 1, 2; n = 3-13) clusters: Comparison with pure copper clusters. J. Comput. Chem. 39 (23) (2018)
Takao Tsuneda, Raman K. Singh, Ayako Nakata
On low-lying excited states of extended nanographenes. J. Comput. Chem. 38 (23) (2017)
Takao Tsuneda, Raman K. Singh, Ayako Nakata
Relationship between orbital energy gaps and excitation energies for long-chain systems. J. Comput. Chem. 37 (16) (2016)
Takao Tsuneda, Satoshi Maeda, Yu Harabuchi, Raman K. Singh
2 Reactions. Comput. 4 (3) (2016)
Takao Tsuneda, Raman K. Singh
Reactivity index based on orbital energies. J. Comput. Chem. 35 (14) (2014)
Raman K. Singh, Takao Tsuneda
Reaction energetics on long-range corrected density functional theory: Diels-Alder reactions. J. Comput. Chem. 34 (5) (2013)