Nonlinear optical response: New in silico Methods and Features

Framework for ab initio calculation of nonlinear optical susceptibilities on the level of Real Time Time Dependent Density Functional Theory was developed and implemented in high performance numerical codes. Methodology was applied to modeling nonlinear response and calculation of nonlinear suscepti...

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Main Author:	Goncharov, Vladimir Anatoliy
Other Authors:	Kalman Varga
Format:	Others
Language:	en
Published:	VANDERBILT 2014
Subjects:	Physics
Online Access:	http://etd.library.vanderbilt.edu/available/etd-03212014-212348/

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spelling	ndltd-VANDERBILT-oai-VANDERBILTETD-etd-03212014-2123482014-04-09T05:01:35Z Nonlinear optical response: New in silico Methods and Features Goncharov, Vladimir Anatoliy Physics Framework for ab initio calculation of nonlinear optical susceptibilities on the level of Real Time Time Dependent Density Functional Theory was developed and implemented in high performance numerical codes. Methodology was applied to modeling nonlinear response and calculation of nonlinear susceptibilities in atoms, molecules, nano structures and crystals. Calculations were routinely compared with available experimental data to ensure reliability of methods. Kalman Varga Andreas Berlind David Ernst Richard Haglund Sait Umar VANDERBILT 2014-04-08 text application/pdf http://etd.library.vanderbilt.edu/available/etd-03212014-212348/ http://etd.library.vanderbilt.edu/available/etd-03212014-212348/ en restrictone I hereby certify that, if appropriate, I have obtained and attached hereto a written permission statement from the owner(s) of each third party copyrighted matter to be included in my thesis, dissertation, or project report, allowing distribution as specified below. I certify that the version I submitted is the same as that approved by my advisory committee. I hereby grant to Vanderbilt University or its agents the non-exclusive license to archive and make accessible, under the conditions specified below, my thesis, dissertation, or project report in whole or in part in all forms of media, now or hereafter known. I retain all other ownership rights to the copyright of the thesis, dissertation or project report. I also retain the right to use in future works (such as articles or books) all or part of this thesis, dissertation, or project report.
collection	NDLTD
language	en
format	Others
sources	NDLTD
topic	Physics
spellingShingle	Physics Goncharov, Vladimir Anatoliy Nonlinear optical response: New in silico Methods and Features
description	Framework for ab initio calculation of nonlinear optical susceptibilities on the level of Real Time Time Dependent Density Functional Theory was developed and implemented in high performance numerical codes. Methodology was applied to modeling nonlinear response and calculation of nonlinear susceptibilities in atoms, molecules, nano structures and crystals. Calculations were routinely compared with available experimental data to ensure reliability of methods.
author2	Kalman Varga
author_facet	Kalman Varga Goncharov, Vladimir Anatoliy
author	Goncharov, Vladimir Anatoliy
author_sort	Goncharov, Vladimir Anatoliy
title	Nonlinear optical response: New in silico Methods and Features
title_short	Nonlinear optical response: New in silico Methods and Features
title_full	Nonlinear optical response: New in silico Methods and Features
title_fullStr	Nonlinear optical response: New in silico Methods and Features
title_full_unstemmed	Nonlinear optical response: New in silico Methods and Features
title_sort	nonlinear optical response: new in silico methods and features
publisher	VANDERBILT
publishDate	2014
url	http://etd.library.vanderbilt.edu/available/etd-03212014-212348/
work_keys_str_mv	AT goncharovvladimiranatoliy nonlinearopticalresponsenewinsilicomethodsandfeatures
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Nonlinear optical response: New in silico Methods and Features

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