Employment
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Indian Association for the Cultivation of Science Senior Professor2016 - Present
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Publications (231)
- Beyond Born Oppenheimer (BBO)‐Based Multi‐Electronic State Diabatic Hamiltonians: Reactive Scattering Processes Save
- The effect of nonadiabaticity in H + H$$_2$$ reaction: A quantum wavepacket dynamics on adiabatic and diabatic potential energy surfaces Save
- Impact of Surface Modes on D2 Scattering from Cu(111): A Time-Dependent Effective Hartree Potential Approach Save
- Vibrationally enhanced product (HeH+) cross section for the reaction, He + H+2 (v = 0 and 1; j = 0) $$ \rightarrow$$ HeH+ + H Save
- The role of electron–nuclear coupling in photoelectron absorption/emission and MATI spectra of organic and inorganic molecules Save
- Non‐Adiabatic Effect in Perovskites: Model and Ab Initio Hamiltonian for Spectral/Ferroelectric Properties Save
- Beyond Born–Oppenheimer Constructed Diabatic Potential Energy Surfaces for H3: Adiabatic and Diabatic Reaction Probabilities Save
- Construction of first-principles-based adiabatic and diabatic Hamiltonians for the TiO68− unit of the BaTiO3 crystal: photoemission spectra and ferroelectricity Save
- Reactive scattering of H2 on Cu(111) at 925 K: Effective Hartree potential vs sudden approximation Save
- Ortho–Para Conversion for H+ + H2 Collision in Low Temperature: A Fully Close-Coupled Time-Dependent Wave Packet Study Save