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Publications by Yago S. de Sousa
Unconventional Channel of Atmospheric Reaction NO + O3 → NO2 + O2 : A Mechanistic Study Using Born-Oppenheimer Molecular Dynamics
Revista Processos Químicos
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Born–Oppenheimer and Renner–Teller Coupled-Channel Quantum Reaction Dynamics of O(3P) + H2+(X2Σg+) Collisions
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An Extrapolation Method for the Efficient Calculation of Molecular Response Properties Within Born–Oppenheimer Molecular Dynamics
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Understanding Liquid–Solid-Like Behavior of Tetrahydrofuran Adlayers at Room Temperature Between Graphene and Mica: A Born–Oppenheimer Molecular Dynamics Study
Journal of Physical Chemistry C
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Dynamics Study of the HO(v‘=0) + O2(v‘ ‘) Branching Atmospheric Reaction. 1. Formation of Hydroperoxyl Radical
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Crossed Molecular Beam Studies of Atmospheric Chemical Reaction Dynamics
On the O2(v′)+O2(v′′) Atmospheric Reaction. II. The Role of Rotational Excitation
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Birkhoff Normal Forms for Born-Oppenheimer Operators
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Reaction and Characterisation of a Two-Stage Thermoset Using Molecular Dynamics
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Reaction Mechanism of the Photooxidation of the Toluene–NO2–O2–N2System in the Gas Phase
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