Time-dependent wave packet dynamics study of the resonances in the H+ LiH+(v= 0, j= 0)→ Li++ H 2 reaction at low collision energies

Y Mao, B Buren, Z Yang, M Chen - Physical Chemistry Chemical …, 2022 - pubs.rsc.org
The depletion process of LiH+ by H collision plays an important role in the evolution of the
early universe and astrophysical processes, including the eventual charge-states …

The stereodynamics of the two reactions: H+ LiH+(v= 0, j= 0)→ H 2+ Li+ and H++ LiH (v= 0, j= 0)→ H 2++ Li

X Li, M Wang, I Pino, C Yang, L Ma - Physical Chemistry Chemical …, 2009 - pubs.rsc.org
Quasi-classical trajectory (QCT) calculations have been carried out to study the
stereodynamics of the reactions H+ LiH+ (v= 0, j= 0)→ H2+ Li+ and H++ LiH (v= 0, j= 0)→ …

On the relative abundance of LiH and LiH+ molecules in the early universe: new results from quantum reactions

S Bovino, M Tacconi, FA Gianturco… - The Astrophysical …, 2011 - iopscience.iop.org
The relative efficiencies of the chemical pathways that can lead to the destruction of LiH and
LiH+ molecules, conjectured to be present in the primordial gas and to control molecular …

Scattering study of the Ne+ NeH+ (v= 0, j= 0)→ NeH++ Ne reaction on an ab initio based analytical potential energy surface

D Koner, L Barrios, T González-Lezana… - The Journal of chemical …, 2016 - pubs.aip.org
Initial state selected dynamics of the Ne+ NeH+(v 0= 0, j 0= 0)→ NeH++ Ne reaction is
investigated by quantum and statistical quantum mechanical (SQM) methods on the ground …

Quasi-classical trajectory study of the adiabatic reactions occurring on the two lowest-lying electronic states of the LiH 2+ system

I Pino, R Martinazzo, GF Tantardini - Physical Chemistry Chemical …, 2008 - pubs.rsc.org
Quasi-classical trajectory calculations have been performed on the adiabatically allowed
reactions taking place on the two lowest-lying electronic states of the LiH2+ system, using …

Potential Energy Surfaces for the First Two Lowest-Lying Electronic States of the LiH2+ System, and Dynamics of the H+ + LiH ⇌ H2+ + Li + Reactions

X He, S Lv, T Hayat, K Han - The Journal of Physical Chemistry A, 2016 - ACS Publications
Two new potential energy surfaces are established for the ground and first excited electronic
states of the LiH2+ system, which are important for the astrophysics-related H++ LiH+ and …

Potential energy surfaces for singlet and triplet states of the LiH 2+ system and quasi-classical trajectory cross sections for H+ LiH+ and H++ LiH

J Hernández-Rodríguez, C Sanz-Sanz… - Physical Chemistry …, 2023 - pubs.rsc.org
A new set of six accurate ab initio potential energy surfaces (PESs) is presented for the first
three singlet and triplet states of LiH2+ (1, 21A′, 11A′′, 1, 23A′, and 13A′′ states …

[HTML][HTML] Quantum and quasi-classical collisional dynamics of O2–Ar at high temperatures

IS Ulusoy, DA Andrienko, ID Boyd… - The Journal of chemical …, 2016 - pubs.aip.org
A hypersonic vehicle traveling at a high speed disrupts the distribution of internal states in
the ambient flow and introduces a nonequilibrium distribution in the post-shock conditions …

Accurate Time-Dependent Wave Packet Study of the Li + H2+ Reaction and Its Isotopic Variants

E Aslan, N Bulut, JF Castillo, L Bañares… - The Journal of …, 2012 - ACS Publications
The dynamics and kinetics of the Li+ H2+ reaction and its isotopic variants (D2+ and T2+)
have been studied by using a time-dependent wave packet (TDWP) coupled-channel (CC) …

Accurate time-dependent wave packet study of the H++ LiH reaction at early universe conditions

E Aslan, N Bulut, JF Castillo, L Bañares… - The Astrophysical …, 2012 - iopscience.iop.org
The dynamics and kinetics of the H++ LiH reaction have been studied using a quantum
reactive time-dependent wave packet (TDWP) coupled-channel quantum mechanical …