Browsing by Author "Vyboishchikov, Sergei F."
orcId Vyboishchikov, Sergei F.​ ​ scopusId Vyboishchikov, Sergei F.​ ​

Density functional energy decomposition into one- and two-atom contributions

Two complementary molecular energy decomposition schemes: the Mayer and Ziegler-Rauk methods in comparison

Theoretical study of reactivity and dynamics of hybride-bridged diruthenium complexes and silylium

Thesis open access ​

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Dynamic behavior of hydrogen in transition metal bis(silyl) hydride complexes

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Structure and hydrogen dynamic behavior in proton sponge cations and organometallic complexes

Thesis open access ​

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Serendipitous metal-catalyzed H-H/Si-H exchange

Modeling exact exchange potential in spherically confined atoms

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Oxidative Cleavage of C=S and P=S Bonds at an AlI Center: Preparation of Terminally Bound Aluminum Sulfides

Correlation energy, correlated electron density, and exchange-correlation potential in some spherically confined atoms

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A Simple Local Correlation Energy Functional for Spherically Confined Atoms from ab Initio Correlation Energy Density

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