M Durga Prasad
Affiliations: | University of Hyderabad, Hyderabad, Telangana, India |
Area:
Theoretical chemistryGoogle:
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Publications
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| Dinesh T, Ravichandran L, Prasad MD. (2020) An equation of motion approach for the vibrational transition energies in the effective harmonic oscillator formalism: the Random phase approximation Journal of Chemical Sciences. 132: 1-8 |
| Banik S, Ravichandran L, Prasad MD. (2017) Raman spectral calculation by vibrational coupled-cluster method in bosonic representation Molecular Physics. 115: 2755-2764 |
| Reddy CS, Prasad MD. (2017) A comparative study of the performance of some density functionals for vibronic spectra Journal of Chemical Sciences. 129: 953-961 |
| Reddy ChS, Prasad MD. (2016) A Gaussian Wave Packet Propagation Approach to Vibrationally Resolved Optical Spectra at Non-Zero Temperatures. The Journal of Physical Chemistry. A. 120: 2583-90 |
| Reddy CS, Prasad MD. (2015) Finite temperature vibronic spectra of harmonic surfaces: a time-dependent coupled cluster approach Molecular Physics. 113: 3023-3030 |
| Banik S, Roy TK, Prasad MD. (2013) A comparative study of independent particle model based approaches for thermal averages Journal of Chemical Sciences. 125: 1267-1275 |
| Banik S, Pal S, Prasad MD. (2012) Vibrational multi-reference coupled cluster theory in bosonic representation. The Journal of Chemical Physics. 137: 114108 |
| Banik S, Prasad MD. (2012) On the spectral intensities of vibrational transitions in polyatomic molecules: Role of electrical and mechanical anharmonicities Theoretical Chemistry Accounts. 131: 1-6 |
| Roy TK, Prasad MD. (2011) Development of a new variational approach for thermal density matrices. The Journal of Chemical Physics. 134: 214110 |
| Saritha B, Prasad MD. (2011) An electronic structure perspective of the promoter modes in proton transfer reactions. The Journal of Physical Chemistry. A. 115: 2802-10 |