A Spectroscopic Description of Asymmetric Isotopologues of CO2
M Bermúdez-Montaña… - The Journal of …, 2023 - ACS Publications
A polyad-conserving algebraic model applied to vibrational excitations of asymmetric
isotopologues of CO2 is presented. First, the problem of vibrational excitations is studied by …
isotopologues of CO2 is presented. First, the problem of vibrational excitations is studied by …
An algebraic alternative for the accurate simulation of CO2 Raman spectra
We present an accurate simulation of the Raman spectrum of the carbon dioxide molecule in
the 1150–1500 cm− 1 spectral range, comparing the results obtained using the three polyad …
the 1150–1500 cm− 1 spectral range, comparing the results obtained using the three polyad …
Vibrational description of the stretching modes of octahedral molecules: a local-to-normal mode transition criterion
L Coello, R Lemus - Molecular Physics, 2021 - Taylor & Francis
A criterion to establish the normal-to-local mode transition in the series of octahedral
molecules SF 6, WF 6 and UF 6 in terms of the suitability to estimate force constants in a …
molecules SF 6, WF 6 and UF 6 in terms of the suitability to estimate force constants in a …
Algebraic vibrational description of the symmetric isotopologues of CO2: 13C16O2, 12C18O2 and 12C17O2
We present a polyad-conserving local model applied to the vibrational excitations of
symmetric isotopologues of carbon dioxide. The description is carried out in the framework …
symmetric isotopologues of carbon dioxide. The description is carried out in the framework …
Algebraic discrete variable representation approach applied to Lennard-Jones and H2 potentials
An algebraic method based on a discrete variable representation (DVR) scheme is applied
to describe 1D potentials. The approach is based on the algebraic realisation of the …
to describe 1D potentials. The approach is based on the algebraic realisation of the …
Connection between the SU (2) Lie algebraic approach and configuration space: application to methylene chloride
The SU (2)-Lie algebraic approach based on the dynamical group U 1 (2)× U 2 (2)×⋯× U n
(2) to describe a set of n local oscillators is analysed from the point of view of its connection …
(2) to describe a set of n local oscillators is analysed from the point of view of its connection …
[PDF][PDF] Joao Francisco da Cruz Vargas
HTNE CO - 2020 - esther.ist.utl.pt
CO2 kinetic and radiative vibrational state-to-state processes (STS) are explored in this
work. Better insights into these processes may lead to more efficient spacecraft design for …
work. Better insights into these processes may lead to more efficient spacecraft design for …
[PDF][PDF] Dynamics of molecular systems
The present edition of MOLEC, the XXI European Conference on the Dynamics of Molecular
Systems, MOLEC 2016, held in Toledo (Spain), has attracted 107 participants from more …
Systems, MOLEC 2016, held in Toledo (Spain), has attracted 107 participants from more …