Open AccessСпектр поглощения гибридной молекулы С-=SUB=-73-=/SUB=-Н-=SUB=-90-=/SUB=-, содержащей дефект Стоуна-Уэльса
Author(s) -
М.С. Чекулаев,
С.Г. Ястребов
Publication year - 2021
Publication title -
pisʹma v žurnal tehničeskoj fiziki
Language(s) - English
Resource type - Journals
eISSN - 1726-7471
pISSN - 0320-0116
DOI - 10.21883/pjtf.2021.24.51797.18951
Subject(s) - maxima , physics , cluster (spacecraft) , interstellar medium , density functional theory , spectrum (functional analysis) , atomic physics , computational physics , astrophysics , computer science , quantum mechanics , galaxy , art , performance art , art history , programming language
The spectral characteristics of hybtid cluster C73H90 were calculated using the time-dependent Density Functional Theory method. The calculated spectrum demonstrates two maxima: at 5.7 and 3.8 eV, which are close to those in interstellar medium and laboretory experiments/