Electronically excited states in poly(p-phenylenevinylene): vertical excitations and torsional potentials from high-level ab initio calculations.
about
Absorption and fluorescence spectra of poly(p-phenylenevinylene) (PPV) oligomers: an ab initio simulation.Charge-transfer states in triazole linked donor-acceptor materials: strong effects of chemical modification and solvation.The correspondence between the conformational and chromophoric properties of amorphous conjugated polymers in mesoscale condensed systems.Excited-state deactivation in 8-oxo-deoxyguanosine: comparison between anionic and neutral forms.Coherent exciton transport driven by torsional dynamics: a quantum dynamical study of phenylene-vinylene type conjugated systems.Intermolecular interactions and charge transfer transitions in aromatic hydrocarbon-tetracyanoethylene complexes.Electronic excitation and structural relaxation of the adenine dinucleotide in gas phase and solution.Investigating the optical properties of BOIMPY dyes using ab initio tools.New tools for the systematic analysis and visualization of electronic excitations. I. Formalism.Choosing an atomic basis set for TD-DFT, SOPPA, ADC(2), CIS(D), CC2 and EOM-CCSD calculations of low-lying excited states of organic dyes
P2860
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P2860
Electronically excited states in poly(p-phenylenevinylene): vertical excitations and torsional potentials from high-level ab initio calculations.
description
2013 nî lūn-bûn
@nan
2013年の論文
@ja
2013年論文
@yue
2013年論文
@zh-hant
2013年論文
@zh-hk
2013年論文
@zh-mo
2013年論文
@zh-tw
2013年论文
@wuu
2013年论文
@zh
2013年论文
@zh-cn
name
Electronically excited states ...... -level ab initio calculations.
@ast
Electronically excited states ...... -level ab initio calculations.
@en
type
label
Electronically excited states ...... -level ab initio calculations.
@ast
Electronically excited states ...... -level ab initio calculations.
@en
prefLabel
Electronically excited states ...... -level ab initio calculations.
@ast
Electronically excited states ...... -level ab initio calculations.
@en
P2093
P2860
P356
P1476
Electronically excited states ...... -level ab initio calculations.
@en
P2093
Adelia J A Aquino
Aditya N Panda
Felix Plasser
Hans Lischka
Irene Burghardt
P2860
P304
P356
10.1021/JP400372T
P407
P577
2013-03-06T00:00:00Z