Photoabsorption spectra of small mercury clusters: A computational study
The result's identifiers
Result code in IS VaVaI
<a href="https://www.isvavai.cz/riv?ss=detail&h=RIV%2F61989100%3A27240%2F18%3A10239596" target="_blank" >RIV/61989100:27240/18:10239596 - isvavai.cz</a>
Alternative codes found
RIV/61989100:27740/18:10239596
Result on the web
<a href="https://pubs.rsc.org/en/content/articlelanding/2018/cp/c8cp04858d#!divAbstract" target="_blank" >https://pubs.rsc.org/en/content/articlelanding/2018/cp/c8cp04858d#!divAbstract</a>
DOI - Digital Object Identifier
<a href="http://dx.doi.org/10.1039/c8cp04858d" target="_blank" >10.1039/c8cp04858d</a>
Alternative languages
Result language
angličtina
Original language name
Photoabsorption spectra of small mercury clusters: A computational study
Original language description
Photoabsorption spectra of small HgN clusters (N = 2-5) have been calculated using a diatomics-in-molecules interaction model and an atoms-in-molecules approach for transition probability calculations. Absorption cross-sections are provided over a broad range of photon energies, Ephot = 4.0-7.5 eV, as calculated for various cluster temperatures ranging between T = 0 K and T = 40 K. Quantum as well as temperature-induced delocalization of nuclear positions has been taken into account at various levels using classical and quantum (path-integral) Monte Carlo methods as well as sampling from the square of cluster vibrational ground-state wavefunctions. A thorough comparison of the calculated data with available experimental records is also provided. (C) the Owner Societies 2018.
Czech name
—
Czech description
—
Classification
Type
J<sub>imp</sub> - Article in a specialist periodical, which is included in the Web of Science database
CEP classification
—
OECD FORD branch
10301 - Atomic, molecular and chemical physics (physics of atoms and molecules including collision, interaction with radiation, magnetic resonances, Mössbauer effect)
Result continuities
Project
Result was created during the realization of more than one project. More information in the Projects tab.
Continuities
P - Projekt vyzkumu a vyvoje financovany z verejnych zdroju (s odkazem do CEP)<br>S - Specificky vyzkum na vysokych skolach
Others
Publication year
2018
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
ISSN
1463-9076
e-ISSN
—
Volume of the periodical
20
Issue of the periodical within the volume
45
Country of publishing house
GB - UNITED KINGDOM
Number of pages
10
Pages from-to
28871-28880
UT code for WoS article
000451089900049
EID of the result in the Scopus database
2-s2.0-85056803552