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Bulletin of the American Physical Society

Coherent control of bond making

Christiane P. Koch

Published May 26, 2016• 0 citations
OpenAlex

Abstract

Liat Levin, Wojciech Skomorowski, Leonid Rybak, Ronnie Kosloff, Christiane P. Koch, and Zohar Amitay The Shirlee Jacobs Femtosecond Laser Research Laboratory, Schulich Faculty of Chemistry, Technion-Israel Institute of Technology, Haifa 32000, Israel Theoretische Physik, Universitat Kassel, Heinrich-Plett-Strase 40, 34132 Kassel, Germany Fritz Haber Research Centre and The Department of Physical Chemistry, Hebrew University, Jerusalem 91904, Israel (Received 5 November 2014; published 10 June 2015)

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Two-photon photoassociation of hot magnesium atoms by femtosecond laser pulses, creating electronically excited magnesium dimer molecules, is studied from first principles, combining ab initio quantum chemistry and molecular quantum dynamics. This theoretical framework allows for rationalizing the generation of molecular rovibrational coherence from thermally hot atoms [L. Rybak, S. Amaran, L. Levin, M. Tomza, R. Moszynski, R. Kosloff, C. P. Koch, and Z. Amitay, Phys. Rev. Lett. 107, 273001 (2011)]. Random phase thermal wavefunctions are employed to model the thermal ensemble of hot colliding atoms. Comparing two different choices of basis functions, random phase wavefunctions built from eigenstates are found to have the fastest convergence for the photoassociation yield. The interaction of the colliding atoms with a femtosecond laser pulse is modeled non-perturbatively to account for strong-field effects.

arXiv:1201.1750•The Journal of Chemical Physics•Oct 28, 2013•37 citations
Liat Levin, Wojciech Skomorowski, Leonid Rybak, Ronnie Kosloff, Christiane P. Koch, and Zohar Amitay The Shirlee Jacobs Femtosecond Laser Research Laboratory, Schulich Faculty of Chemistry, Technion-Israel Institute of Technology, Haifa 32000, Israel Theoretische Physik, Universitat Kassel, Heinrich-Plett-Strase 40, 34132 Kassel, Germany Fritz Haber Research Centre and The Department of Physical Chemistry, Hebrew University, Jerusalem 91904, Israel (Received 5 November 2014; published 10 June 2015)
ADVERTISEMENT RETURN TO ISSUEPREVReviewNEXTCoherent Control of Ultracold PhotoassociationChristiane P. Koch*† and Moshe Shapiro*‡View Author Information† Theoretische Physik, Universität Kassel, Heinrich-Plett-Strasse 40, 34132 Kassel, Germany‡ Department of Chemistry, University of British Columbia, Vancouver, Canada V6T 1Z1, and Department of Chemical Physics, The Weizmann Institute, Rehovot, Israel 76100*E-mail: [email protected]; [email protected]Cite this: Chem. Rev. 2012, 112, 9, 4928–4948Publication Date (Web):April 10, 2012Publication History Received7 October 2011Published online10 April 2012Published inissue 12 September 2012https://doi.org/10.1021/cr2003882Copyright © 2012 American Chemical SocietyRIGHTS & PERMISSIONSArticle Views2138Altmetric-Citations67LEARN ABOUT THESE METRICSArticle Views are the COUNTER-compliant sum of full text article downloads since November 2008 (both PDF and HTML) across all institutions and individuals. These metrics are regularly updated to reflect usage leading up to the last few days.Citations are the number of other articles citing this article, calculated by Crossref and updated daily. Find more information about Crossref citation counts.The Altmetric Attention Score is a quantitative measure of the attention that a research article has received online. Clicking on the donut icon will load a page at altmetric.com with additional details about the score and the social media presence for the given article. Find more information on the Altmetric Attention Score and how the score is calculated. Share Add toView InAdd Full Text with ReferenceAdd Description ExportRISCitationCitation and abstractCitation and referencesMore Options Share onFacebookTwitterWechatLinked InReddit Read OnlinePDF (7 MB) Get e-AlertsSUBJECTS:Excited states,Lasers,Molecules,Quantum mechanics,Resonance structures Get e-Alerts
1 Fritz-Haber-Institut der Max-Planck-Gesellschaft, 14195 Berlin, Germany 2 Max-Born-Institut fur Nichtlineare Optik und Kurzzeitspektroskopie, 12489 Berlin, Germany 3 California Institute of Technology, Pasadena, California 91125, USA Medical Faculty, Physics Department, University of Rijeka, 51000 Rijeka, Croatia Steacie Institute for Molecular Sciences, National Research Council Canada, Ottawa, Ontario K1A 0R6, Canada Institut fur Physikalische Chemie, Universitat Wurzburg, 97074 Wurzburg, Germany Institute of Multidisciplinary Research for Advanced Materials, Tohoku University, Sendai 980-8577, Japan Max-Planck-Institut fur Physik komplexer Systeme, 01187 Dresden, Germany
Two-photon photoassociation of hot magnesium atoms by femtosecond laser pulses, creating electronically excited magnesium dimer molecules, is studied from first principles, combining ab initio quantum chemistry and molecular quantum dynamics. This theoretical framework allows for rationalizing the generation of molecular rovibrational coherence from thermally hot atoms [L. Rybak, S. Amaran, L. Levin, M. Tomza, R. Moszynski, R. Kosloff, C. P. Koch, and Z. Amitay, Phys. Rev. Lett. 107, 273001 (2011)]. Random phase thermal wavefunctions are employed to model the thermal ensemble of hot colliding atoms. Comparing two different choices of basis functions, random phase wavefunctions built from eigenstates are found to have the fastest convergence for the photoassociation yield. The interaction of the colliding atoms with a femtosecond laser pulse is modeled non-perturbatively to account for strong-field effects.