Anions of the hydrogen-bonded guanine-cytosine dimer - Theoretical study

Johan Smets; Abraham F. Jalbout; Ludwik Adamowicz

doi:10.1016/S0009-2614(01)00588-7

Anions of the hydrogen-bonded guanine-cytosine dimer - Theoretical study

Johan Smets, Abraham F. Jalbout, Ludwik Adamowicz

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Abstract

The quantum mechanical calculations performed in this work revealed an interesting nature of the stationary states of an excess electron in the guanine-cytosine (G-C) anion. The electron can form either a dipole-bound (DB) state or a covalent state. The coexistence of the two states may enhance the ability of the G-C dimer to capture an excess electron.

Original language	English (US)
Pages (from-to)	342-346
Number of pages	5
Journal	Chemical Physics Letters
Volume	342
Issue number	3-4
DOIs	https://doi.org/10.1016/S0009-2614(01)00588-7
State	Published - Jul 13 2001

ASJC Scopus subject areas

Physics and Astronomy(all)
Physical and Theoretical Chemistry

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10.1016/S0009-2614(01)00588-7

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title = "Anions of the hydrogen-bonded guanine-cytosine dimer - Theoretical study",

abstract = "The quantum mechanical calculations performed in this work revealed an interesting nature of the stationary states of an excess electron in the guanine-cytosine (G-C) anion. The electron can form either a dipole-bound (DB) state or a covalent state. The coexistence of the two states may enhance the ability of the G-C dimer to capture an excess electron.",

author = "Johan Smets and Jalbout, {Abraham F.} and Ludwik Adamowicz",

note = "Funding Information: The authors gratefully acknowledge support from the National Science Foundation. ",

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AU - Smets, Johan

AU - Jalbout, Abraham F.

AU - Adamowicz, Ludwik

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PY - 2001/7/13

Y1 - 2001/7/13

N2 - The quantum mechanical calculations performed in this work revealed an interesting nature of the stationary states of an excess electron in the guanine-cytosine (G-C) anion. The electron can form either a dipole-bound (DB) state or a covalent state. The coexistence of the two states may enhance the ability of the G-C dimer to capture an excess electron.

AB - The quantum mechanical calculations performed in this work revealed an interesting nature of the stationary states of an excess electron in the guanine-cytosine (G-C) anion. The electron can form either a dipole-bound (DB) state or a covalent state. The coexistence of the two states may enhance the ability of the G-C dimer to capture an excess electron.

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Anions of the hydrogen-bonded guanine-cytosine dimer - Theoretical study

Abstract

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