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Physical Chemistry Chemical Physics : PCCP|December 17, 2016
Electronic forces as descriptors of nucleophilic and electrophilic regioselectivity and stereoselectivityShubin Liu, Chunying Rong, Tian LuThe Journal of Chemical Physics|January 21, 2014
Dissecting molecular descriptors into atomic contributions in density functional reactivity theoryChunying Rong, Tian Lu, Shubin LiuThe Journal of Physical Chemistry. A|March 1, 2018
Identifying Strong Covalent Interactions with Pauli EnergyShubin Liu, Chunying Rong, Tian Lu, et al.Physical Chemistry Chemical Physics : PCCP|January 5, 2018
Steric chargeShubin Liu, Lianghong Liu, Donghai Yu, et al.Journal of Computational Chemistry|October 28, 2017
Molecular acidity: An accurate description with information-theoretic approach in density functional reactivity theoryXiaofang Cao, Chunying Rong, Aiguo Zhong, et al.The Journal of Physical Chemistry. A|April 23, 2021
Quantifications and Applications of Relative Fisher Information in Density Functional TheoryBin Wang, Dongbo Zhao, Tian Lu, et al.The Journal of Chemical Physics|June 3, 2019
Using Pauli energy to appraise the quality of approximate semilocal non-interacting kinetic energy density functionalsSiyuan Liu, Dongbo Zhao, Chunying Rong, et al.ACS Omega|August 29, 2019
Baird's Rule in Substituted Fulvene Derivatives: An Information-Theoretic Study on Triplet-State Aromaticity and AntiaromaticityDonghai Yu, Chunying Rong, Tian Lu, et al.The Journal of Physical Chemistry. A|April 27, 2016
Information Functional Theory: Electronic Properties as Functionals of Information for Atoms and MoleculesXia-Yu Zhou, Chunying Rong, Tian Lu, et al.Physical Chemistry Chemical Physics : PCCP|September 29, 2015
Density functional reactivity theory study of SN2 reactions from the information-theoretic perspectiveZemin Wu, Chunying Rong, Tian Lu, et al.Pageof 74