نتایج جستجو برای: electron correlation

تعداد نتایج: 687495  

Journal: :The Journal of Chemical Physics 1966

Journal: :The Journal of Chemical Physics 2011

Journal: :Journal of Applied Mathematics and Physics 2014

Journal: :The Journal of Chemical Physics 1968

2003
G. M. Sigaud E. C. Montenegro

The Independent Event Model (IEVM) is used to analyze collision processes for systems with three and four electrons, in situations where up to three active electrons are involved and dynamical correlation effects play a major role. The model is applied to single electron loss and loss-ionization processes. All the possible ionization mechanisms for both collision partners in each exit channel a...

Journal: :Physical review letters 2014
Li Zhang Xinhua Xie Stefan Roither Yueming Zhou Peixiang Lu Daniil Kartashov Markus Schöffler Dror Shafir Paul B Corkum Andrius Baltuška André Staudte Markus Kitzler

Double ionization of neon with orthogonally polarized two-color (OTC) laser fields is investigated using coincidence momentum imaging. We show that the two-electron emission dynamics in nonsequential double ionization can be controlled by tuning the subcycle shape of the electric field of the OTC pulses. We demonstrate experimentally switching from correlated to anticorrelated two-electron emis...

پایان نامه :وزارت علوم، تحقیقات و فناوری - دانشگاه شیراز - دانشکده علوم 1391

in this research we have studied the effect of some transition-metals (cu, ag and au) substitutions on two-electron reduction potential of flavins by application of dft method. all geometries have been optimized at blyp level of theory and “6-31+g** + lanl2dz” mixed basis set. the frequency job at the same method and basis sets has been performed to obtain gibbs free energy of compounds. it h...

2015
L. Baldassarre A. Perucchi M. Mitrano D. Nicoletti C. Marini D. Pontiroli M. Mazzani M. Aramini M. Riccó G. Giovannetti M. Capone S. Lupi

Cs3C60 is an antiferromagnetic insulator that under pressure (P) becomes metallic and superconducting below Tc = 38 K. The superconducting dome present in the T - P phase diagram close to a magnetic state reminds what found in superconducting cuprates and pnictides, strongly suggesting that superconductivity is not of the conventional Bardeen-Cooper-Schrieffer (BCS) type We investigate the insu...

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