Initialising ...
Initialising ...
Initialising ...
Initialising ...
Initialising ...
Initialising ...
Initialising ...
Ito, Takashi; Higemoto, Wataru; Shimomura, Koichiro*
Physical Review B, 108(22), p.224301_1 - 224301_11, 2023/12
Times Cited Count：5 Percentile：44.45(Materials Science, Multidisciplinary)
potential energy surfaces for the lowest three doublet states (1
A', 2A', and 1A") of the BrH
systemKurosaki, Yuzuru; Takayanagi, Toshiyuki
Journal of Chemical Physics, 119(15), p.7838 - 7856, 2003/10
Times Cited Count：26 Percentile：62.97(Chemistry, Physical)Adiabatic potential energy surfaces of the lowest three doublet states (1A', 2A', and 1A") for the BrH system have been calculated globally using the MRCI+Q method with the aug-cc-pVTZ basis set. Spin-orbit effects were considered on the basis of Breit-Pauli Hamiltonian. The calculated adiabatic energies were fitted to the analytical functional form of many-body expansion. The barrier heights of the abstraction and exchange reactions on the ground-state PES were calculated to be 1.28 and 11.71 kcal mol
, respectively, at the MRCI+Q/aug-cc-pVTZ level of theory. The fits for the three PESs were successful within the accuracy of 0.1 kcal mol. Thermal rate constants for the abstraction and exchange reactions and their isotopic variants were calculated with the fitted 1A' PES using the ICVT/LAG method. The calculated rate constants for the abstarction reactions agree fairly well with experiment but those for the exchange reactions were much smaller than experiment, which suggests that the reliable experimental data are still insufficient.
Fujita, Ayumi
Physical Review B, 64(6), p.064504_1 - 064504_6, 2001/08
Times Cited Count：0 Percentile：0.00(Materials Science, Multidisciplinary)We study parametric level statistics of the discretized excitation spectra inside a moving vortex core in layered superconductors with impurities. The universal conductivity is evaluated numerically for the various values of rescaled vortex velocities 
from the clean case to the dirty limit case. The random matrix theoretical prediction is verified numerically in the large regime. On the contrary in the low velocity regime, we observe 
which is consistent with the theoretical result for the super-clean case, where the energy dissipation is due to the Landau-Zener transition which takes place at the points called ``avoided crossing''.
Nakamura, Hideo; Anoda, Yoshinari; Kukita, Yutaka
ANS Proc. 1991 National Heat Transfer Conf., Vol. 5, p.269 - 276, 1991/00
no abstracts in English
;
Physical Review A, 42(4), p.2176 - 2183, 1990/08
Times Cited Count：5 Percentile：36.30(Optics)no abstracts in English
;
Physical Review A, 41(4), p.1990 - 1996, 1990/02
Times Cited Count：18 Percentile：67.93(Optics)no abstracts in English
;
Journal of Non-Crystalline Solids, 117-118, p.92 - 95, 1990/00
Times Cited Count：5 Percentile：43.26(Materials Science, Ceramics)no abstracts in English
;
Proc. of the Yamada Conf. XXIV on Strongly Coupled Plasma Physics, p.683 - 686, 1990/00
no abstracts in English
; ; ; ; ; ; ;
JAERI-M 9901, 14 Pages, 1982/01
no abstracts in English
Pb(CH
COO)
Journal of the Physical Society of Japan, 40(2), p.483 - 489, 1976/02
Times Cited Count：23no abstracts in English
