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NeI2 Photofragmentation Dynamics Through Quasiclassical and Semiclassical Studies

Chemphyschem, 2023-10, Vol.24 (20), p.e202300406-e202300406

2023

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Mechanistic Insights into the Formation of Lithium Fluoride Nanotubes

Chemistry : a European journal, 2019-04, Vol.25 (20), p.5269-5279

2019

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Topical issue on dynamics and photodynamics: from isolated molecules to the condensed phase

The European physical journal. D, Atomic, molecular, and optical physics, 2023-12, Vol.77 (12), Article 210

2023

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Photofragmentation dynamics study of ArBr2(v=16,…,25) using two theoretical methods: trajectory surface hopping and quasiclassical trajectories

The European physical journal. D, Atomic, molecular, and optical physics, 2022-05, Vol.76 (5)

2022

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Vibrational predissociation study of NeIBr(A) using Quasiclassical Trajectories and Trajectory Surface Hopping methods

Chemical physics letters, 2024-08, Vol.849, p.141427, Article 141427

2024

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Simulation of deflection and photon emission of ultra-relativistic electrons and positrons in a quasi-mosaic bent silicon crystal

Journal of physics. B, Atomic, molecular, and optical physics, 2024-09, Vol.57 (17), p.175203

2024

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Study of the Vibrational Predissociation of the NeBr2 Complex by Computational Simulation Using the Trajectory Surface Hopping Method

Mathematics (Basel), 2020-11, Vol.8 (11), p.2029

2020

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Relaxation of ArH+ by collision with He: Isotopic effects

Astronomy and astrophysics (Berlin), 2019-11, Vol.631, p.A86

2019

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Vibrational predissociation dynamics of the nitric oxide dimer

The European physical journal. D, Atomic, molecular, and optical physics, 2018-07, Vol.72 (7), p.1-6, Article 121

2018

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

The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory, 2010-09, Vol.114 (36), p.9673-9680

2010

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Topical Issue on atomic cluster collisions

The European physical journal. D, Atomic, molecular, and optical physics, 2019-07, Vol.73 (7), p.1-7, Article 154

2019

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Capture approximations beyond a statistical quantum mechanical method for atom-diatom reactions

The European physical journal. D, Atomic, molecular, and optical physics, 2016-03, Vol.70 (3), Article 57

2016

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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 Delocalization

The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory, 2009-12, Vol.113 (52), p.14399-14406

2009

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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

International journal of quantum chemistry, 2008, Vol.108 (10), p.1821-1830

2008

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Fragmentation dynamics of NO–NO dimer: A quasiclassical dynamics study

Chemical physics letters, 2013-03, Vol.563, p.20-24

2013

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Quasi-classical trajectories study of Ne2Br2(B) vibrational predissociation: kinetics and product distributions

The Journal of chemical physics, 2012-04, Vol.136 (14), p.144303-144303

2012

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

The Journal of chemical physics, 2007-04, Vol.126 (13), p.134315-134315-9

2007

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Dynamics of exciplex formation in rare gas media

Chemical physics, 2009-07, Vol.362 (1), p.34-40

2009

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

The European physical journal. D, Atomic, molecular, and optical physics, 2018-11, Vol.72 (11), Article 195

2018

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A theoretical simulation of the resonant Raman spectroscopy of the H2O⋯Cl2 and H2O⋯Br2 halogen-bonded complexes

The Journal of chemical physics, 2016-02, Vol.144 (5), p.054307-054307

2016

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Quasi-classical trajectory calculations of cross sections and rate constants for the Si+OH→SiO+H reaction

Chemical physics letters, 2014-08, Vol.610-611, p.335-340

2014

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Ultrafast, correlated multidimensional shell dynamics of neon matrices after photoexcitation of an NO impurity: An MCTDH approach

Chemical physics letters, 2012-08, Vol.543, p.12-18

2012

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A New ab Initio Potential Energy Surface for Studying Vibrational Relaxation in NO(v) + NO Collisions

The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory, 2011-04, Vol.115 (13), p.2892-2899

2011

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Response of solid Ne upon photoexcitation of a NO impurity: A quantum dynamics study

The Journal of chemical physics, 2011-10, Vol.135 (16), p.164504-164504-11

2011

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Two-Photon Excited Fluorescence Dynamics in NADH in Water–Methanol Solutions: The Role of Conformation States

The journal of physical chemistry. B, 2020-11, Vol.124 (47), p.10682-10697

2020

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NeI2 Photofragmentation Dynamics Through Quasiclassical and Semiclassical Studies

Mechanistic Insights into the Formation of Lithium Fluoride Nanotubes

Topical issue on dynamics and photodynamics: from isolated molecules to the condensed phase

Photofragmentation dynamics study of ArBr2(v=16,…,25) using two theoretical methods: trajectory surface hopping and quasiclassical trajectories

Vibrational predissociation study of NeIBr(A) using Quasiclassical Trajectories and Trajectory Surface Hopping methods

Simulation of deflection and photon emission of ultra-relativistic electrons and positrons in a quasi-mosaic bent silicon crystal

Study of the Vibrational Predissociation of the NeBr2 Complex by Computational Simulation Using the Trajectory Surface Hopping Method

Relaxation of ArH+ by collision with He: Isotopic effects

Vibrational predissociation dynamics of the nitric oxide dimer

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

Topical Issue on atomic cluster collisions

Capture approximations beyond a statistical quantum mechanical method for atom-diatom reactions

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 Delocalization

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

Fragmentation dynamics of NO–NO dimer: A quasiclassical dynamics study

Quasi-classical trajectories study of Ne2Br2(B) vibrational predissociation: kinetics and product distributions

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

Dynamics of exciplex formation in rare gas media

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

A theoretical simulation of the resonant Raman spectroscopy of the H2O⋯Cl2 and H2O⋯Br2 halogen-bonded complexes

Quasi-classical trajectory calculations of cross sections and rate constants for the Si+OH→SiO+H reaction

Ultrafast, correlated multidimensional shell dynamics of neon matrices after photoexcitation of an NO impurity: An MCTDH approach

A New ab Initio Potential Energy Surface for Studying Vibrational Relaxation in NO(v) + NO Collisions

Response of solid Ne upon photoexcitation of a NO impurity: A quantum dynamics study

Two-Photon Excited Fluorescence Dynamics in NADH in Water–Methanol Solutions: The Role of Conformation States

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