Binding of divalent cations to acetate: molecular simulations guided by Raman spectroscopy
The result's identifiers
Result code in IS VaVaI
<a href="https://www.isvavai.cz/riv?ss=detail&h=RIV%2F61388963%3A_____%2F20%3A00534503" target="_blank" >RIV/61388963:_____/20:00534503 - isvavai.cz</a>
Result on the web
<a href="https://doi.org/10.1039/D0CP02987D" target="_blank" >https://doi.org/10.1039/D0CP02987D</a>
DOI - Digital Object Identifier
<a href="http://dx.doi.org/10.1039/d0cp02987d" target="_blank" >10.1039/d0cp02987d</a>
Alternative languages
Result language
angličtina
Original language name
Binding of divalent cations to acetate: molecular simulations guided by Raman spectroscopy
Original language description
In this study we report the first use of Raman multivariate curve resolution (Raman-MCR) vibrational spectroscopy to obtain self-consistent free and bound metal acetate spectra and one-to-one binding constants, without the need to invoke any a priori assumptions regarding the shapes of the corresponding vibrational bands.
Czech name
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Czech description
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Classification
Type
J<sub>imp</sub> - Article in a specialist periodical, which is included in the Web of Science database
CEP classification
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OECD FORD branch
10403 - Physical chemistry
Result continuities
Project
Result was created during the realization of more than one project. More information in the Projects tab.
Continuities
I - Institucionalni podpora na dlouhodoby koncepcni rozvoj vyzkumne organizace
Others
Publication year
2020
Confidentiality
S - Úplné a pravdivé údaje o projektu nepodléhají ochraně podle zvláštních právních předpisů
Data specific for result type
Name of the periodical
Physical chemistry chemical physics : PCCP
ISSN
1463-9084
e-ISSN
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Volume of the periodical
22
Issue of the periodical within the volume
41
Country of publishing house
GB - UNITED KINGDOM
Number of pages
14
Pages from-to
24014-24027
UT code for WoS article
000582937400049
EID of the result in the Scopus database
2-s2.0-85094932027