Resultant Information Description of Electronic States and Chemical Processes

Volume: 123, Issue: 45, Pages: 9737 - 9752
Published: Oct 30, 2019
Abstract
General variations of electronic states are discussed, and the state "vertical" and "horizontal" displacements are explored. Quantum dynamics of the wave function modulus and phase components is examined, and the associated continuity relations are summarized. The probability and current contributions to overall information-theoretic (IT) descriptors of the state global and gradient entropy/information content are identified. These resultant...
Paper Details
Title
Resultant Information Description of Electronic States and Chemical Processes
Published Date
Oct 30, 2019
Volume
123
Issue
45
Pages
9737 - 9752
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