Orbital-dependent density functionals: Theory and applications

S Kümmel, L Kronik - Reviews of Modern Physics, 2008 - APS
This review provides a perspective on the use of orbital-dependent functionals, which is
currently considered one of the most promising avenues in modern density-functional …

Toward systematic understanding of diversity of electronic properties in low-dimensional molecular solids

H Seo, C Hotta, H Fukuyama - Chemical reviews, 2004 - ACS Publications
Solids exhibit a variety of electronic properties such as elastic, magnetic, thermodynamic,
transport properties, etc. Above all, the difference between insulating and metallic properties …

[HTML][HTML] Control of electronic polarization via charge ordering and electron transfer: electronic ferroelectrics and electronic pyroelectrics

SQ Su, SQ Wu, S Kanegawa, K Yamamoto… - Chemical Science, 2023 - pubs.rsc.org
Ferroelectric, pyroelectric, and piezoelectric compounds whose electric polarization
properties can be controlled by external stimuli such as electric field, temperature, and …

Theoretical aspects of charge ordering in molecular conductors

H Seo, J Merino, H Yoshioka, M Ogata - Journal of the Physical …, 2006 - jstage.jst.go.jp
accepted February 20, 2006; published May 10, 2006) Theoretical studies on charge
ordering phenomena in quarter-filled molecular (organic) conductors are reviewed …

Absence of charge order in the dimerized -phase BEDT-TTF salts

K Sedlmeier, S Elsässer, D Neubauer, R Beyer… - Physical Review B …, 2012 - APS
Utilizing infrared vibrational spectroscopy we have investigated dimerized two-dimensional
organic salts in order to search for possible charge redistribution that might constitute …

[HTML][HTML] Modern history of organic conductors: An overview

T Naito - Crystals, 2021 - mdpi.com
This short review article provides the reader with a summary of the history of organic
conductors. To retain a neutral and objective point of view regarding the history …

Materials viewpoint of organic superconductors

H Mori - Journal of the Physical Society of Japan, 2006 - journals.jps.jp
Since the first discovery of an organic superconductor, TMTSF 2 PF 6 (TMTSF=
tetramethyltetraselenafulvalene) with the superconducting transition temperature (T c)= 0.9 …

First-principles study of the surface energy and work function of III-V semiconductor compounds

W Liu, WT Zheng, Q Jiang - Physical Review B—Condensed Matter and …, 2007 - APS
Surface energy and work function of 12 III-V semiconductors, AlP, AlAs, AlSb, AlBi, GaP,
GaAs, GaSb, GaBi, InP, InAs, InSb, and InBi, on (110) surfaces are calculated using ab initio …

Deterministic generation of three-dimensional entanglement for two atoms separately trapped in two optical cavities

SY Ye, ZR Zhong, SB Zheng - Physical Review A—Atomic, Molecular, and …, 2008 - APS
A scheme is proposed for the deterministic generation of three-dimensional entanglement of
two distant atoms separately trapped in two optical cavities connected by an optical fiber …

Donor–anion interactions in quarter-filled low-dimensional organic conductors

JP Pouget, P Alemany, E Canadell - Materials Horizons, 2018 - pubs.rsc.org
Anions have often been considered to act essentially as electron donors or acceptors in
molecular conductors. However there is now growing evidence that they play an essential …