화학공학소재연구정보센터
검색결과 : 13건
No. Article
1 Quantum Stabilization of the Frustrated Hydrogen Bonding Structure in the Hydrogen Fluoride Trimer
Io A, Kawatsu T, Tachikawa M
Journal of Physical Chemistry A, 123(37), 7950, 2019
2 Synthesis and Stereochemical Properties of Chiral Hetero[7]helicenes Structured by a Benzodiheterole Ring Core
Arae S, Mori T, Kawatsu T, Ueda D, Shigeta Y, Hamamoto N, Fujimoto H, Sumimoto M, Imahori T, Igawa K, Tomooka K, Punniyamurthy T, Irie R
Chemistry Letters, 46(8), 1214, 2017
3 Synthesis and Stereochemical Properties of Chiral Hetero[7]helicenes Structured by a Benzodiheterole Ring Core
Arae S, Mori T, Kawatsu T, Ueda D, Shigeta Y, Hamamoto N, Fujimoto H, Sumimoto M, Imahori T, Igawa K, Tomooka K, Punniyamurthy T, Irie R
Chemistry Letters, 46(8), 1214, 2017
4 Solvent Dependence of Double Proton Transfer in the Formic Acid-Formamidine Complex: Path Integral Molecular Dynamics Investigation
Kungwan N, Ngaojampa C, Ogata Y, Kawatsu T, Oba Y, Kawashima Y, Tachikawa M
Journal of Physical Chemistry A, 121(39), 7324, 2017
5 Isotope effects of ammonia umbrella flip using semiclassical instanton calculations based on discretized path integrals
Kawatsu T, Miura S
Chemical Physics Letters, 634, 146, 2015
6 Chemical-intuition based LMO transformation simplifies excited-state wave functions of peptides
Hasegawa J, Kawatsu T, Toyota K, Matsuda K
Chemical Physics Letters, 508(1-3), 171, 2011
7 Bridge-Mediated Excitation Energy Transfer Pathways through Protein Media: a Slater Determinant-Based Electronic Coupling Calculation Combined with Localized Molecular Orbitals
Kawatsu T, Matsuda K, Hasegawa J
Journal of Physical Chemistry A, 115(39), 10814, 2011
8 Conformationally averaged score functions for electronic propagation in proteins
Kawatsu T, Beratan DN, Kakitani T
Journal of Physical Chemistry B, 110(11), 5747, 2006
9 Interference, fluctuation, and alternation of electron tunneling in protein media. 1. Two tunneling routes in photosynthetic reaction center alternate due to thermal fluctuation of protein conformation
Nishioka H, Kimura A, Yamato T, Kawatsu T, Kakitani T
Journal of Physical Chemistry B, 109(5), 1978, 2005
10 Interference, fluctuation, and alternation of electron tunneling in protein media. 2. Non-Condon theory for the energy gap dependence of electron transfer rate
Nishioka H, Kimura A, Yamato T, Kawatsu T, Kakitani T
Journal of Physical Chemistry B, 109(32), 15621, 2005