Published December 23, 2010 | Version v1
Journal article

Spontaneous symmetry breaking by double lithium adsorption in polyacenes

  • 1. Instituto de Ciencias Fisicas, Universidad Nacional Autonoma de Mexico, Cuernavaca, Morelos (Mexico)
  • 2. Centro Internacional de Ciencias, Cuernavaca, Morelos (Mexico)

Description

We show that adsorption of one lithium atom to polyacenes, i.e. chains of linearly fused benzene rings, will cause such chains to be slightly deformed. If we adsorb a second identical atom on the opposite side of the same ring, this deformation is dramatically enhanced despite the fact that a symmetric configuration seems possible. We argue, that this may be due to an instability of the Jahn-Teller type possibly indeed to a Peierls instability.

Additional details

Identifiers

Publishing Information

Journal Title
AIP Conference Proceedings
Journal Volume
1323
Journal Issue
1
Journal Page Range
p. 257-264
ISSN
0094-243X
CODEN
APCPCS

Conference

Title
Symposium on symmetries in nature in memoriam Marcos Moshinsky
Dates
7-14 Aug 2010
Place
Cuernavaca (Mexico)

INIS

Country of Publication
United States
Country of Input or Organization
International Atomic Energy Agency (IAEA)
INIS RN
42103083
Subject category
S74: ATOMIC AND MOLECULAR PHYSICS; S37: INORGANIC, ORGANIC, PHYSICAL AND ANALYTICAL CHEMISTRY;
Resource subtype / Literary indicator
Conference
Descriptors DEI
ADSORPTION; ATOMS; BENZENE; CONFIGURATION; DEFORMATION; DENSITY FUNCTIONAL METHOD; FULLERENES; INSTABILITY; JAHN-TELLER EFFECT; LITHIUM; SIMULATION; SYMMETRY
Descriptors DEC
ALKALI METALS; AROMATICS; CALCULATION METHODS; CARBON; ELEMENTS; HYDROCARBONS; METALS; NONMETALS; ORGANIC COMPOUNDS; SORPTION; VARIATIONAL METHODS

Optional Information

Notes
(c) 2010 American Institute of Physics