Relative electron affinities of substituted benzophenones, nitrobenzenes, and quinones

1985 ◽  
Vol 107 (8) ◽  
pp. 2291-2296 ◽  
Author(s):  
Elaine K. Fukuda ◽  
Robert T. McIver
Keyword(s):  
Electron Affinities ◽  
Relative Electron

Relative electron affinities of substituted nitrobenzenes in the gas phase

1983 ◽  
Vol 87 (16) ◽  
pp. 2993-2995 ◽  
Author(s):  
Elaine K. Fukuda ◽  
Robert T. McIver
Keyword(s):  
Gas Phase ◽  
Electron Affinities ◽  
Relative Electron

The electron affinity of tetracyanoethylene and other organic electron acceptors

1976 ◽  
Vol 29 (9) ◽  
pp. 1919 ◽  
Author(s):  
LE Lyons ◽  
LD Palmer
Keyword(s):  
Electron Affinity ◽  
Organic Molecules ◽  
Threshold Energy ◽  
Negative Ions ◽  
Surface Ionization ◽  
Electron Affinities ◽  
Strong Electron ◽  
A Value ◽  
Organic Electron ◽  
Relative Electron

Information on the molecular structure of tetracyanoethylene and its mononegative ion is used to derive the electron affinity of tetracyanoethylene from the experimentally determined threshold energy for photodetachment of electrons from the negative ions. The resultant electron affinity of 2.3(� 0.3) eV is 0.6(� 0.4) eV less than a value derived by the magnetron surface ionization technique. Relative electron affinities for the strong electron acceptor organic molecules, which are known from charge-transfer spectra, are placed on an absolute scale using the photodetachment result for tetracyanoethylene.

Adiabatic electron affinities of PF5 and SF6: a coupled-cluster study

1998 ◽  
Vol 94 (1) ◽  
pp. 121-125 ◽  
Author(s):  
Gennady GUTSEV ◽  
RODNEY BARTLETT
Keyword(s):  
Coupled Cluster ◽  
Electron Affinities

scholarly journals Predicting the new carbon nanocages, fullerynes: a DFT study

2021 ◽  
Vol 11 (1) ◽  
Author(s):  
Mohammad Qasemnazhand ◽  
Farhad Khoeini ◽  
Farah Marsusi
Keyword(s):  
Density Functional Theory ◽  
Lithium Ion Batteries ◽  
Density Functional ◽  
Lithium Ion ◽  
The Other ◽  
Electron Affinities ◽  
Chemical Formula ◽  
Functional Theory ◽  
Triple Bonds ◽  
Structural And Electronic Properties

AbstractIn this study, based on density functional theory, we propose a new branch of pseudo-fullerenes which contain triple bonds with sp hybridization. We call these new nanostructures fullerynes, according to IUPAC. We present four samples with the chemical formula of C4nHn, and the structures derived from fulleranes. We compare the structural and electronic properties of these structures with those of two common fullerenes and fulleranes systems. The calculated electron affinities of the sampled fullerynes are negative, and much smaller than those of fullerenes, so they should be chemically more stable than fullerenes. Although fulleranes also exhibit higher chemical stability than fullerynes, but pentagon or hexagon of the fullerane structures cannot pass ions and molecules. Applications of fullerynes can be included in the storage of ions and gases at the nanoscale. On the other hand, they can also be used as cathode/anode electrodes in lithium-ion batteries.

Electron affinities of benzaldehydes. Substituent effects on stabilities of aromatic radical anions

1993 ◽  
Vol 34 (26) ◽  
pp. 4223-4226 ◽  
Author(s):  
Masaaki Mishima ◽  
Chul Huh ◽  
Hirotaka Nakamura ◽  
Mizue Fujio ◽  
Yuho Tsuno
Keyword(s):  
Substituent Effects ◽  
Radical Anions ◽  
Electron Affinities ◽  
Aromatic Radical
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