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Fujita, Hirohiko*; Fujita, Yoshitaka*; Utsuno, Yutaka; Yoshida, Kenichi*; Adachi, Tatsuya*; Algora, A.*; Csatls, M.*; Deaven, J. M.*; Estevez-Aguado, E.*; Guess, C. J.*; et al.
Physical Review C, 100(3), p.034618_1 - 034618_13, 2019/09
Times Cited Count:12 Percentile:76.6(Physics, Nuclear)no abstracts in English
Kobayashi, Takanori*; Matsuoka, Leo*; Yokoyama, Keiichi
Computational and Theoretical Chemistry, 1150, p.40 - 48, 2019/02
Times Cited Count:1 Percentile:1.99(Chemistry, Physical)One of important research targets in the development of cesium isotope separation system is design of recovery process of cesium atom. Relevant to this research target, the reaction cross section and reaction rate constant of a cesium exchange reaction through collision of the cesium iodide molecules with cesium atoms are calculated by a quasi-classical trajectory calculation based on a potential energy surface obtained by quantum chemistry calculations. Consequently, the rate constant is calculated to be 3.6 10 cmmolecules, as large as collision rate in the present condition. In addition, slightly positive temperature dependence is observed in the rate constant. This behavior is explained with the long-range attractive force and effect of subsequent dissociation process.
Kobayashi, Takanori*; Matsuoka, Leo*; Yokoyama, Keiichi
Nihon Enerugi Gakkai-Shi, 96(10), p.441 - 444, 2017/10
To investigate the reaction cross section of the cesium exchange reaction of CsI (v = 0, j = 0) + Cs Cs + ICs, we performed quasi-classical trajectory calculations on the potential energy surface calculated by the ab initio molecular orbital theory. The potential energy surface shows that intermediate CsI is formed without entrance barrier and has two equivalent Cs-I bonds. The reaction cross sections decrease monotonically with increasing collision energy. The rate constant k (v = 0, j = 0) was estimated to be about 310cm molecules at temperatures ranging from 500 to 1200K and a slight negative temperature dependence was observed.
Kobayashi, Takanori; Hashimoto, Masashi; Yokoyama, Keiichi
JAEA-Research 2015-014, 7 Pages, 2015/12
To discuss the exchange reaction of Cs isotope by CsI + Cs' Cs + ICs', the structure and chemical properties of CsI intermediate and potential energy surface are calculated using M06/def2-TZVPPD density functional calculation. The calculation shows that the reaction to the intermediate has no barrier and the two Cs-I bonds of CsI are chemically equivalent. Thus, the collision of CsI + Cs' results in Cs exchange with the high probability.
Nakazawa, Tetsuya; Yokoyama, Keiichi; Grismanovs, V.*; Katano, Yoshio*; Jitsukawa, Shiro
Journal of Nuclear Materials, 307-311(Part2), p.1436 - 1440, 2002/12
Times Cited Count:1 Percentile:10.13(Materials Science, Multidisciplinary)no abstracts in English
Nakazawa, Tetsuya; Yokoyama, Keiichi; Grismanovs, V.*; Katano, Yoshio*; Jitsukawa, Shiro
Journal of Nuclear Materials, 302(2-3), p.165 - 174, 2002/04
Times Cited Count:3 Percentile:23.39(Materials Science, Multidisciplinary)no abstracts in English
Nakazawa, Tetsuya; Yokoyama, Keiichi; Grismanovs, V.*; Katano, Yoshio*
Journal of Nuclear Materials, 297(1), p.69 - 76, 2001/07
Times Cited Count:9 Percentile:56.04(Materials Science, Multidisciplinary)no abstracts in English
Yoshii, Kenji
Journal of Alloys and Compounds, 305(1-2), p.72 - 75, 2000/06
Times Cited Count:13 Percentile:61.56(Chemistry, Physical)no abstracts in English
Sherrill, B. M.*; Akimune, Hidetoshi; Austin, S. M.*; Bazin, D.*; Van den Berg, A. M.*; Berg, G. P. A.*; Caggiano, J.*; Daito, Izuru*; Fujimura, Hisako*; Fujita, Yoshitaka*; et al.
Nuclear Instruments and Methods in Physics Research A, 432(2-3), p.299 - 304, 1999/08
Times Cited Count:39 Percentile:91.81(Instruments & Instrumentation)no abstracts in English
Nishikawa, Masabumi*; *; Kawamura, Yoshinori; Nishi, Masataka
JAERI-Conf 98-006, p.170 - 182, 1998/03
no abstracts in English
Kawamura, Yoshinori; Enoeda, Mikio; Okuno, Kenji
Fusion Engineering and Design, 39-40, p.713 - 721, 1998/00
Times Cited Count:8 Percentile:57.22(Nuclear Science & Technology)no abstracts in English
Nishikawa, Masabumi*; Baba, Atsushi*; *; Kawamura, Yoshinori
Fusion Engineering and Design, 39-40, p.615 - 625, 1998/00
Times Cited Count:14 Percentile:72.98(Nuclear Science & Technology)no abstracts in English
Ito, Rinsuke*; Tabata, Tatsuo*; Shirai, Toshizo; R.A.Phaneuf*
JAERI-Data/Code 96-024, 62 Pages, 1996/07
no abstracts in English
Kawamura, Yoshinori; Nishikawa, Masabumi*; *; Okuno, Kenji
Journal of Nuclear Materials, 230, p.287 - 294, 1996/00
Times Cited Count:43 Percentile:94.6(Materials Science, Multidisciplinary)no abstracts in English
Yui, Mikazu; Shibata, Masahiro; Makino, Hitoshi; ; ; Ishiguro, Katsuhiko; Ishikawa, Hirohisa
PNC TN8410 92-162, 140 Pages, 1992/09
None
; ; Kurasawa, T.; ;
JAERI-M 86-130, 20 Pages, 1986/09
no abstracts in English
Kurasawa, T.; ; ; ; ;
JAERI-M 84-087, 55 Pages, 1984/05
no abstracts in English
Nakashima, Mikio; Tachikawa, Enzo; Saeki, Masakatsu;
Journal of Inorganic and Nuclear Chemistry, 43(2), p.369 - 373, 1981/00
Times Cited Count:8 Percentile:37.89(Chemistry, Inorganic & Nuclear)no abstracts in English
; ; Motoishi, Shoji; ;
JAERI-M 5320, 31 Pages, 1973/07
no abstracts in English