34 citations · 129 across the 12 of their papers we have counts for
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physics.chem-ph2022★ 30 cited
Ro-vibrational energy and thermodynamic properties of molecules subjected to Deng-Fan potential through an improved approximation
Debraj Nath, Amlan K. Roy
Accurate solution of the Schrödinger equation with Deng-Fan potential is presented by means of Nikiforov-Uvarov method. A modified Pekeris-type approximation is proposed for the ce…
physics.chem-ph2022★ 4 cited
A self-consistent systematic optimization of range-separated hybrid functionals from first principles
Abhisek Ghosal, Amlan K. Roy
In this communication, we represent a self-consistent systematic optimization procedure for the development of optimally tuned (OT) range-separated hybrid (RSH) functionals from \e…
physics.chem-ph2019
Density functional electric response properties of molecules in Cartesian grid
Abhisek Ghosal, Tanmay Mandal, Amlan K. ~Roy
Within the finite-field Kohn-Sham framework, static electric response properties of diatomic molecules are presented. The electronic energy, dipole moment ({\boldmath}), static…