Normal and hyperspherical mode analysis of NO-doped Kr crystals upon Rydberg excitation of the impurity

JC Castro Palacio, L Velazquez Abad… - The Journal of …, 2007 - pubs.aip.org
Molecular dynamics simulations and both normal mode and hyperspherical mode analyses
of NO-doped Kr solid are carried out in order to get insights into the structural relaxation of …

Ab initio ground and excited state potential energy surfaces for NO–Kr complex and dynamics of Kr solids with NO impurity

JC Castro-Palacios, J Rubayo-Soneira… - The Journal of …, 2007 - pubs.aip.org
The intermolecular potentials for the NO (X Π 2)–Kr and NO (A Σ+ 2)–Kr systems have been
calculated using highly accurate ab initio calculations. The spin-restricted coupled cluster …

Molecular dynamics simulations and hyperspherical mode analysis of NO in Kr crystals with the use of ab initio potential energy surfaces for the Kr‐NO complex

JC Castro Palacio, J Rubayo‐Soneira… - … Journal of Quantum …, 2008 - Wiley Online Library
The dynamics of structural relaxation of NO doped Kr solids on electronic excitation of the
NO molecule has been characterized by molecular dynamics simulations and by normal and …

Electronic spectroscopy of NO–(Rg) x complexes (Rg= Ne, Ar) via the 4s and 3d Rydberg states

DE Bergeron, A Musgrave, VL Ayles… - The Journal of …, 2006 - pubs.aip.org
We have employed (2+ 1) resonance enhanced multiphoton ionization spectroscopy to
investigate the 3 d and 4 s Rydberg states of the NO molecule when bound to the surface of …

Argon Solid Response upon Rydberg Photoexcitation of the NO Chromosphore: Case of Using ab Initio Potential Energy Surfaces and Comparison to Similar Studied …

JC Castro-Palacio, K Ishii, F Ayala-Mató… - The Journal of …, 2010 - ACS Publications
Molecular dynamics simulations of NO-doped Ar solid upon Rydberg photoexcitation of the
impurity have been carried out taking into account angular dependent potential energy …

On the Local Relaxation of Solid Neon upon Rydberg Excitation of a NO Impurity: The Role of the NO (A)− Ne Interaction Potential and Zero-Point Quantum …

P Pajón-Suárez, GA Rojas-Lorenzo… - The Journal of …, 2009 - ACS Publications
The local relaxation of solid neon subsequent to the impulsive excitation of the NO
chromophore to its A (3sσ) Ryberg state is investigated using molecular dynamics …

An ab initio study of the Ar–NO (A Σ2+) intermolecular potential

JC Castro-Palacio, K Ishii, J Rubayo-Soneira… - The Journal of …, 2009 - pubs.aip.org
More complete molecular dynamics simulations of NO doped Ar solid upon photoexcitation
of the impurity should include effects of angular variations of Ar–NO intermolecular potential …

Dynamics of NO(A2Σ+X2Π) photoexcitation in rare gas and H2 solid matrices

L Savio-Rodríguez, A Gutiérrez-Quintanilla… - The European Physical …, 2018 - Springer
In the present work, the energy relaxation process in doped solid matrices is studied. The
photoexcitation of NO molecule to its first electronic Rydberg state, being trapped in argon …

An ab initio study of Xe–NO (X2II) and Xe–NO (A2Σ+) potential energy surfaces

JC Castro-Palacio, K Ishii, J Rubayo-Soneira… - Procedia Computer …, 2011 - Elsevier
The potential energy surfaces (PESs) of Xe–NO (X2II) and Xe–NO (A2Σ+) complexes have
been obtained using highly accurate ab initio calculations. Analytical representations of …

DINÁMICA ESTRUCTURAL FOTOINDUCIDA EN SÓLIDOS DE GASES NOBLES.

A MARTÍNEZ MESA… - Revista Cubana de …, 2012 - search.ebscohost.com
PACS: Femtosecond probes of molecules in solids and of molecular solids, 82.53. Xa; Time-
resolved optical spectroscopies and other ultrafast optical measurements in condensed …