Structural, Electronic, and Optical Properties of Organic Electronic Materials from Density Functional Theory

Leeor Kronik

doi:10.1364/LS.2015.LM3H.3

Structural, Electronic, and Optical Properties of Organic Electronic Materials from Density Functional Theory

Leeor Kronik

Department of Molecular Chemistry and Materials Science Perlman

Weizmann Institute of Science

Research output: Chapter in Book/Report/Conference proceeding › Conference contribution › peer-review

Abstract

In this presentation, I show how advanced approaches within density functional theory, namely dispersive corrections and optimal tuning of range-separated hybrid functionals, can lead to quantitative predictive power for structural, electronic, and optical properties of organic electronic materials.

Original language	English
Title of host publication	OSA Technical Digest (online) (Optica Publishing Group, 2015)
ISBN (Electronic)	9781943580033
DOIs	https://doi.org/10.1364/LS.2015.LM3H.3
State	Published - Oct 2015
Event	Laser Science, LS 2015 - San Jose, United States Duration: 18 Oct 2015 → 22 Oct 2015

Publication series

Name	Optics InfoBase Conference Papers

Conference

Conference	Laser Science, LS 2015
Country/Territory	United States
City	San Jose
Period	18/10/15 → 22/10/15

All Science Journal Classification (ASJC) codes

Electronic, Optical and Magnetic Materials
Mechanics of Materials

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10.1364/LS.2015.LM3H.3

Cite this

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title = "Structural, Electronic, and Optical Properties of Organic Electronic Materials from Density Functional Theory",

abstract = "In this presentation, I show how advanced approaches within density functional theory, namely dispersive corrections and optimal tuning of range-separated hybrid functionals, can lead to quantitative predictive power for structural, electronic, and optical properties of organic electronic materials.",

author = "Leeor Kronik",

note = "Publisher Copyright: {\textcopyright} OSA 2015.; Laser Science, LS 2015 ; Conference date: 18-10-2015 Through 22-10-2015",

year = "2015",

month = oct,

doi = "10.1364/LS.2015.LM3H.3",

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AB - In this presentation, I show how advanced approaches within density functional theory, namely dispersive corrections and optimal tuning of range-separated hybrid functionals, can lead to quantitative predictive power for structural, electronic, and optical properties of organic electronic materials.

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U2 - 10.1364/LS.2015.LM3H.3

DO - 10.1364/LS.2015.LM3H.3

M3 - منشور من مؤتمر

T3 - Optics InfoBase Conference Papers

BT - OSA Technical Digest (online) (Optica Publishing Group, 2015)

T2 - Laser Science, LS 2015

Y2 - 18 October 2015 through 22 October 2015

ER -

Structural, Electronic, and Optical Properties of Organic Electronic Materials from Density Functional Theory

Abstract

Publication series

Conference

All Science Journal Classification (ASJC) codes

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