Article ID Journal Published Year Pages File Type
5383420 Chemical Physics Letters 2012 6 Pages PDF
Abstract
► Efficient quantum chemistry method for the quantum hydrogen effect. ► Density functional theory with the hydrogen quantum effect. ► Population analysis for the hydrogen quantum effect. ► Hydrogen network with the nuclear quantum effect.
Related Topics
Physical Sciences and Engineering Chemistry Physical and Theoretical Chemistry
Preview
Efficient density functional theory calculations with weak hydrogen quantum effect: Electron density analysis
Authors
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