Theoretical Study of Metallophilic Interactions and Excited States of Heterobimetallic d10−d8Complexes with Bridging Ligands: The Tuning of Electronic Spectroscopy

2010 ◽  
Vol 29 (15) ◽  
pp. 3261-3270 ◽  
Author(s):  
Qing-Jiang Pan ◽  
Yuan-Ru Guo ◽  
Hong-Xing Zhang
Keyword(s):  
Excited States ◽  
Theoretical Study ◽  
Electronic Spectroscopy ◽  
Bridging Ligands ◽  
Metallophilic Interactions

A Theoretical Study of the Low-Lying Excited States oftrans- andcis-Urocanic Acid

1999 ◽  
Vol 103 (48) ◽  
pp. 9864-9871 ◽  
Author(s):  
Christopher S. Page ◽  
Manuela Merchán ◽  
Luis Serrano-Andrés ◽  
Massimo Olivucci
Keyword(s):  
Excited States ◽  
Theoretical Study ◽  
Urocanic Acid

Experimental and theoretical study of core-excited states of Al III

1990 ◽  
Vol 42 (5) ◽  
pp. 543-550 ◽  
Author(s):  
J O Gaardsted ◽  
T Brage ◽  
C Froese Fischer ◽  
D Sonnek
Keyword(s):  
Excited States ◽  
Theoretical Study

scholarly journals Erratum to: Theoretical Study of the Electronic Excited States and Fluorescence Spectra of Squaraine in Solution

2014 ◽  
Vol 43 (9-10) ◽  
pp. 1644-1644
Author(s):  
Hitoshi Ozawa ◽  
Kazunori Yashiro ◽  
Takuma Yamamoto ◽  
Satoshi Yabushita
Keyword(s):  
Excited States ◽  
Fluorescence Spectra ◽  
Theoretical Study ◽  
Electronic Excited States

Theoretical Study of the Electronic Excited States of Tetracyanoethylene and Its Radical Anion

ChemPhysChem ◽  
2005 ◽  
Vol 6 (3) ◽  
pp. 503-510 ◽  
Author(s):  
Begoña Milián ◽  
Rosendo Pou-Amérigo ◽  
Manuela Merchán ◽  
Enrique Ortí
Keyword(s):  
Excited States ◽  
Radical Anion ◽  
Theoretical Study ◽  
Electronic Excited States

scholarly journals A theoretical study of the electronic spectroscopy of the SiF3 radical

2001 ◽  
Vol 342 (5-6) ◽  
pp. 599-602 ◽  
Author(s):  
F.R. Manby ◽  
R.P. Tuckett ◽  
P.J. Knowles
Keyword(s):  
Theoretical Study ◽  
Electronic Spectroscopy

QUANTUM REFLECTION, EVAPORATION, AND TRANSPORT CURRENTS AT 4He SURFACES

2006 ◽  
Vol 20 (30n31) ◽  
pp. 5047-5056
Author(s):  
V. APAJA ◽  
E. KROTSCHECK ◽  
A. RIMNAC ◽  
R. E. ZILLICH
Keyword(s):  
Excited States ◽  
Theoretical Study ◽  
Transport Phenomena ◽  
Microscopic Theory ◽  
Second Order ◽  
Quantum Liquid ◽  
Quantum Reflection ◽  
Quantum Liquids ◽  
Inhomogeneous Quantum

In this work, we study transport currents in excited states. This requires the calculation of particle currents [Formula: see text] to second order in the excitation amplitudes. For that purpose, we take a well-tested microscopic theory of inhomogeneous quantum liquids and extend it to find the mass currents created when atoms scatter off a surface or when excitations evaporate atoms. This is the first theoretical study of transport phenomena in a quantum liquid based on a quantitative microscopic theory.

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