Back to Results
First PageMeta Content
Hybrid functional / Time-dependent density functional theory / Crystal / Chemistry / Density functional theory / Physics


ARTICLE pubs.acs.org/JPCA TD-CI Simulation of the Electronic Optical Response of Molecules in Intense Fields II: Comparison of DFT Functionals and EOM-CCSD Jason A. Sonk and H. Bernhard Schlegel*
Add to Reading List

Document Date: 2012-01-05 13:44:13


Open Document

File Size: 3,72 MB

Share Result on Facebook

City

Salvador / Berlin / Antwerp / Amsterdam / Melville / Champaign / Wallingford / Austin / Stoychev / New York / /

Company

Toyota / Demeras A. S. / Plenum Press / EOM-CC / Sauer S. P. A. / CAM-B3LYP104 LC / J.A.S. / EOM / Wolfram Research Inc. / Honda / /

Country

Germany / Belgium / United States / /

Event

Business Partnership / /

Facility

Wayne State University / National Institute of Standards and Technology / American Institute of Physics / /

IndustryTerm

method energy / larger many-electron systems / few electron systems / average excited state energy / higher energy states / average excitation energy / excitation energy / real-time integration / state energy / energy states / energy width / rst excitation energy / larger polyatomic systems / energy / /

Organization

American Chemical Society / National Institute of Standards and Technology / Wayne State University / Detroit / American Institute of Physics / National Science Foundation / H. Bernhard Schlegel* Department of Chemistry / /

Person

Fox / H. Bernhard Schlegel / Jason A. Sonk / Singh / Tozer / /

Position

R. D. J. / A. D. J. / representative / /

Product

Skullcandy G.I. Headphone/Headset / /

ProvinceOrState

South Dakota / Illinois / New York / Connecticut / Michigan / /

PublishedMedium

The Journal of Physical Chemistry A / /

Technology

laser / lasers / simulation / /

SocialTag