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Browsing by Author SHUKLA, A

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Issue DateTitleAuthor(s)
2000Ab initio Hartree-Fock Born effective charges of LiH, LiF, LiCl, NaF, and NaClSHUKLA, A
2002Ab initio many-body calculations of static dipole polarizabilities of linear carbon chains and chainlike boron clustersABDURAHMAN, A; SHUKLA, A; SEIFERT, G
2002Ab initio many-body calculations on infinite carbon and boron-nitrogen chainsABDURAHMAN, A; SHUKLA, A; DOLG, M
2006Ab initio real-space Hartree-Fock and correlated approach to optical dielectric constants of crystalline insulatorsSONY, P; SHUKLA, A
2008Ab initio Wannier-function-based correlated calculations of Born effective charges of crystalline Li(2)O and LiClSONY, P; SHUKLA, A
2004Ab initio Wannier-function-based many-body approach to Born charges of crystalline insulatorsSONY, P; SHUKLA, A
2012Control of dc capacitor voltages in diode-clamped multilevel inverter using bidirectional buck-boost choppersSHUKLA, A; GHOSH, A; JOSHI, A
2002Correlated theory of triplet photoinduced absorption in phenylene-vinylene chainsSHUKLA, A
2010Energetics and electronic structure of phenyl-disubstituted polyacetylene: A first-principles studySONY, P; SHUKLA, A; AMBROSCH-DRAXL, C
2012A Fortran 90 Hartree-Fock program for one-dimensional periodic pi-conjugated systems using Pariser-Parr-Pople modelKONDAYYA, G; SHUKLA, A
2009Fortran 90 implementation of the Hartree-Fock approach within the CNDO/2 and INDO modelsSAHU, S; SHUKLA, A
2010A general purpose Fortran 90 electronic structure program for conjugated systems using Pariser-Parr-Pople modelSONY, P; SHUKLA, A
2007Kinetically balanced Gaussian basis-set approach to relativistic Compton profiles of atomsJAISWAL, P; SHUKLA, A
2007Large-scale correlated calculations of linear optical absorption and low-lying excited states of polyacenes: pariser-parr-pople hamiltonianSONY, P; SHUKLA, A
2009Large-scale correlated study of excited state absorptions in naphthalene and anthraceneSONY, P; SHUKLA, A
2013Optical absorption in boron clusters B-6 and B-6(+): a first principles configuration interaction singles approachSHINDE, R; SHUKLA, A
2013Pariser-Parr-Pople Model Based Investigation of Ground and Low-Lying Excited States of Long AcenesCHAKRABORTY, H; SHUKLA, A
2005Photoinduced absorption in disubstituted polyacetylenes: Comparison of theory with experimentsSONY, P; SHUKLA, A
2008Photophysics of charge-transfer excitons in thin films of pi-conjugated polymersWANG, ZD; MAZUMDAR, S; SHUKLA, A
2010Probing Aromaticity of Borozene Through Optical and Dielectric Response: A Theoretical StudySAHU, S; SHUKLA, A
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