Molecular Clusters: Potential Energy and Free Energy Surfaces. Quantum Chemical ab initio and Computer Simulation Studies.
The result's identifiers
Result code in IS VaVaI
<a href="https://www.isvavai.cz/riv?ss=detail&h=RIV%2F61388955%3A_____%2F01%3A54010233" target="_blank" >RIV/61388955:_____/01:54010233 - isvavai.cz</a>
Result on the web
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DOI - Digital Object Identifier
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Alternative languages
Result language
angličtina
Original language name
Molecular Clusters: Potential Energy and Free Energy Surfaces. Quantum Chemical ab initio and Computer Simulation Studies.
Original language description
Modern chemistry is based on the understanding of the chemical bond. The chemical bond implies the distribution and delocalization of electrons over the entire molecule. Molecules can interact in two ways-reactively (leading to the formation or breakingof a covalent bond) or nonreactively (formation of molecular complex). Non-covalent (van der Waals) interactions have been studied in this paper using methods of modern quantum chemistry.
Czech name
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Czech description
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Classification
Type
C - Chapter in a specialist book
CEP classification
CH - Nuclear and quantum chemistry, photo chemistry
OECD FORD branch
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Result continuities
Project
<a href="/en/project/IAA4040904" target="_blank" >IAA4040904: Potential energy surfaces and free energy surfaces of floppy systems</a><br>
Continuities
P - Projekt vyzkumu a vyvoje financovany z verejnych zdroju (s odkazem do CEP)
Others
Publication year
2001
Confidentiality
S - Úplné a pravdivé údaje o projektu nepodléhají ochraně podle zvláštních právních předpisů
Data specific for result type
Book/collection name
Atomic Clusters and Nanoparticles.
ISBN
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Number of pages of the result
20
Pages from-to
565-584
Number of pages of the book
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Publisher name
Springer
Place of publication
Berlin
UT code for WoS chapter
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