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Multielectron effects in strong-field ionization of the oriented OCS molecule

Mahmoud Abu-samha, Lars Bojer Madsen

2020Physical review. A/Physical review, A14 citationsDOIOpen Access PDF

Abstract

We present theoretical calculations of orientation-dependent total ionization yields from the highest occupied molecular orbitals of the oriented OCS molecule by solving the time-dependent Schr\"odinger equation in three dimensions. The calculations were performed within the single-active-electron approximation including multielectron polarization. The multielectron polarization term was represented by an induced dipole term which contains the polarizability of the ${\mathrm{OCS}}^{+}$ cation parallel to the laser polarization. Upon accounting for multielectron polarization, the calculated total ionization yields and their orientation dependence are in good agreement with experimental data.

Topics & Concepts

PolarizabilityIonizationAtomic physicsDipolePolarization (electrochemistry)ChemistryMoleculeElectronAtomic orbitalIonPhysicsMolecular physicsQuantum mechanicsPhysical chemistryOrganic chemistryLaser-Matter Interactions and ApplicationsAdvanced Chemical Physics StudiesSpectroscopy and Quantum Chemical Studies
Multielectron effects in strong-field ionization of the oriented OCS molecule | Litcius