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19942026
most citedParallel Tempering Algorithm for Conformational Studies of Biological Molecules

1k citations

Showing 2011Show all

9 papers · 1 filter

cond-mat.mtrl-sci2011★ 55 cited

Observation of warping effects in the band and angular momentum structures of topological insulator Bi2Te3

Wonsig Jung, Yeongkwan Kim, Beomyoung Kim +10

We performed angle resolved photoemission (ARPES) experiments on Bi2Te3 with circularly polarized light. ARPES data show very strong circular dichroism, indicating existence of orb…

physics.chem-ph2011★ 27 cited

Auger decay of molecular double core-hole state

Motomichi Tashiro, Kiyoshi Ueda, Masahiro Ehara

We report on theoretical Auger electron kinetic energy distribution originated from sequential two-step Auger decays of molecular double core-hole (DCH) state, using CH4, NH3 and H…

cond-mat.str-el2011★ 23 cited

13C NMR study of the magnetic properties of the quasi-one-dimensional conductor, (TMTTF)2SbF6

F. Iwase, K. Sugiura, K. Furukawa +1

Magnetic properties in the quasi-one-dimensional organic salt (TMTTF)2SbF6 are investigated by 13C NMR under pressures. Antiferromagnetic phase transition at ambient pressure (AFI)…

cond-mat.str-el2011★ 2 cited

Nonlinear Conduction by Melting of Stripe-Type Charge Order in Organic Conductors with Triangular Lattices

Yasuhiro Tanaka, Kenji Yonemitsu

We theoretically discuss the mechanism for the peculiar nonlinear conduction in quasi-two-dimensional organic conductors θ-(BEDT-TTF)2X [BEDT-TTF=bis(ethylenedithio)tetrathiafulval…

cond-mat.str-el2011★ 61 cited

Optical study of charge instability in CeRu2Al10 in comparison with CeOs2Al10 and CeFe2Al10

Shin-ichi Kimura, Takuya Iizuka, Hidetoshi Miyazaki +7

The anisotropic electronic structure responsible for the antiferromagnetic transition in CeRuAl at the unusually high temperature of = 28 K was studied using optic…

cond-mat.str-el2011★ 14 cited

Photoexcitation-Energy-Dependent Transition Pathways from a Dimer Mott Insulator to a Metal

Kenji Yonemitsu, Satoshi Miyashita, Nobuya Maeshima

We theoretically study pump-photon-energy-dependent pathways of a photoinduced dimer-Mott-insulator-to-metal transition, on the basis of numerical solutions to the time-dependent S…

cond-mat.str-el2011★ 10 cited

Effects of Lattice and Molecular Phonons on Photoinduced Neutral-to-Ionic Transition Dynamics in Tetrathiafulvalene--Chloranil

Kenji Yonemitsu

For electronic states and photoinduced charge dynamics near the neutral-ionic transition in the mixed-stack charge-transfer complex tetrathiafulvalene--chloranil (TTF-CA), we re…

cond-mat.str-el2011★ 104 cited

Momentum-Dependent Hybridization Gap and dispersive in-gap state of The Kondo Semiconductor SmB6

Hidetoshi Miyazaki, Tetsuya Hajiri, Takahiro Ito +2

We report the temperature-dependent three-dimensional angle-resolved photoemission spectra of the Kondo semiconductor SmB. We found a difference in the temperature dependence o…

cond-mat.str-el2011★ 15 cited

Crossover from bias-induced to field-induced breakdowns in one-dimensional band and Mott insulators attached to electrodes

Yasuhiro Tanaka, Kenji Yonemitsu

Nonequilibrium states induced by an applied bias voltage (V) and the corresponding current-voltage characteristics of one-dimensional models describing band and Mott insulators are…