Entropic descriptors of the chemical bond in H2: Local resolution of stockholder atoms

DOI10.1007/S10910-008-9391-6MaRDI QIDQ839334zbMATH OpenOpenAlexFDO

Authors Roman F. Nalewajski

Publication date 2 September 2009

Published in Journal of Mathematical Chemistry (Search for Journal in Brave)

Full work available at URL https://doi.org/10.1007/s10910-008-9391-6

zbMATH Keywords

information theorycommunication theorybond indiceschemical-bond theorycovalent/ionic bond compositionhydrogen moleculelocal information channelsstockholder atoms

Mathematics Subject Classification ID

Measures of information, entropy (94A17) Molecular structure (graph-theoretic methods, methods of differential topology, etc.) (92E10)

Recommendations

• Entropy/information descriptors of the chemical bond revisited
• Use of non-additive information measures in exploring molecular electronic structure: Stockholder bonded atoms and role of kinetic energy in the chemical bond
• Communications in molecules: local and multi-configuration channels and their entropic descriptors of bond multiplicity and composition
• Entropy/information bond indices of molecular fragments
• Entropic bond indices from molecular information channels in orbital resolution: ground-state systems

Cites work

• Chemical bonds through probability scattering: Information channels for intermediate-orbital stages
• Entropic bond indices from molecular information channels in orbital resolution: ground-state systems
• Entropy/information bond indices of molecular fragments

Cited in

(9)

• Chemical bond and entanglement of electrons in the hydrogen molecule
• Entropy/information bond indices of molecular fragments
• Many-orbital probabilities and their entropy/information descriptors in orbital communication theory of the chemical bond
• On phases and interference of local communications in molecules
• Additive and non-additive information channels in orbital communication theory of the chemical bond
• Use of non-additive information measures in exploring molecular electronic structure: Stockholder bonded atoms and role of kinetic energy in the chemical bond
• Communications in molecules: local and multi-configuration channels and their entropic descriptors of bond multiplicity and composition
• On \textit{phase}-equilibria in molecules
• Electron attraction and the chemical bond

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