Density Functional Theory in Quantum Chemistry

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Cover of 'Density Functional Theory in Quantum Chemistry'

Table of Contents

Attention for Chapter 4: Kohn–Sham Method

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So far, Dimensions has found 143 publications that cite this research output.

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Exploring the spectral and nonlinear optical properties of phenyl isothiocyanate through density functional theory and molecular docking studies: A comprehensive analysis of a potent biologically active phytochemical

Article in Hybrid Advances (August 2024)

Theoretical Study of the Adsorption of Some Azoles on the Graphene Surface

Article in Russian Journal of Physical Chemistry A (May 2024)

Density functional theory (DFT) studies in HDAC-based chemotherapeutics: Current findings, case studies and future perspectives

Article in Computers in Biology and Medicine (April 2024)

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