80 citations · 109 across the 3 of their papers we have counts for
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cond-mat.mtrl-sci2009★ 21 cited
Large-scale correlated study of excited state absorptions in naphthalene and anthracene
Priya Sony, Alok Shukla
In this paper, we report theoretical calculations of the photo-induced absorption (PA) spectrum of naphthalene and anthracene, with the aim of understanding those excited states, w…
cond-mat.mtrl-sci2008★ 8 cited
Ab initio Wannier-function-based correlated calculations of Born effective charges of crystalline LiO and LiCl
Priya Sony, Alok Shukla
In this paper we have used our recently developed ab initio Wannier-function-based methodology to perform extensive Hartree-Fock and correlated calculations on LiO and LiCl t…
cond-mat.mtrl-sci2007★ 80 cited
A large-scale correlated study of linear optical absorption and low-lying excited states of polyacenes: Pariser-Parr-Pople Hamiltonian
Priay Sony, Alok Shukla
In this paper we present large-scale correlated calculations of linear optical absorption spectrum of oligo-acenes containing up to seven benzene rings. For the calculations we use…