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Kohn–Sham Decomposition in Real-Time Time-Dependent Density-Functional Theory: An Efficient Tool for Analyzing Plasmonic Excitations

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Toward exact predictions of spin-phonon relaxation times: An ab initio implementation of open quantum systems theory

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Independent gradient model based on Hirshfeld partition: A new method for visual study of interactions in chemical systems - Lu - 2022 - Journal of Computational Chemistry - Wiley Online Library

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Distinguishing Asphyxia from Sudden Cardiac Death as the Cause of Death from the Lung Tissues of Rats and Humans Using Fourier Transform Infrared Spectroscopy

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