42 results on '"Tsuzuki, Seiji"'
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2. Effects of Li ion-solvent interaction on ionic transport and electrochemical properties in highly concentrated cyclic carbonate electrolytes
3. Structural evaluation and protium-deuterium exchange in 1-ethyl-3-methylimidazolium halide-ethylene glycol mixtures
4. Magnitude of attraction in CF4-CH4 interactions: Are CF4-CH4 interactions weaker than average of CF4-CF4 and CH4-CH4 interactions?
5. Anion effects on amorphization and crystallization in room-temperature ionic liquids
6. Self-assembled 2D patterns of structural isomers in isobutenyl compounds revealed by STM at solid/liquid interface
7. Solvation state of sodium tetraphenylborate in 3-methylpyridine and its aqueous solutions
8. Computational investigation of π-bond strengths in fluorinated ethylenes
9. Photo-Fries rearrangement of phenyl salicylate studied by two-dimensional infrared spectroscopy
10. Preference of the monodentate contact in the CH/π interaction between an alkyl group and a single phenyl ring: Stable structures of benzene–ethane clusters
11. Effects of cation and anion on physical properties of room-temperature ionic liquids
12. Two-dimensional structures of pyrimido[5,4- d]pyrimidine derivatives at solid/liquid interface
13. Self-assembly of bipyridine derivatives at solid/liquid interface: Effects of the number of peripheral alkyl chains and metal coordination on the two-dimensional structures
14. Influence of ligand structures on methanol electro-oxidation by mixed catalysts based on platinum and organic metal complexes for DMFC
15. A theoretical study on the strength of two-center three-electron bonds in the NO 3 radical adducts of reduced sulfur molecules, H 2S, CH 3SH, CH 3SCH 3, and CH 3SSCH 3
16. The tetraalkylammonium-accelerated Norrish-Yang photocyclization of 2-substituted acetophenones
17. 2,6-Diaminopyridine derivatives as models of molecular sensor for nucleic acid base detection: ab initio calculations of electronic effects induced by hydrogen bonds formation
18. A theoretical study on the strength of two-center three-electron bond in (CH 3) 2S–OH and H 2S–OH adducts
19. Ab initio conformational analysis of fluoromethyl formate and difluoromethyl formate
20. Two-dimensional self-assembled structures of adenine molecules: modeling and simulation
21. Importance of secondary electrostatic interactions in hydrogen-bonding complexes: an investigation using the self-consistent charge and configuration method for subsystems
22. The mutual polarization of reactants: Fukui function description of the charge reorganization
23. Ab initio study of the hydrolysis of carbonyl difluoride (CF 2O): importance of an additional water molecule
24. Gas-phase energy differences between the Z and E rotamers and the rotational barrier heights of methyl formate and trifluromethyl formate: an ab initio study
25. Measurement of the second moment of a Raman band
26. Raman linewidth study of intermolecular interactions of methanol in aqueous solution
27. Basis set effects on the intermolecular interaction of hydrocarbon molecules obtained by an ab initio molecular orbital method: evaluation of dispersion energy
28. Comparison of atomic charge distributions obtained from different procedures: basis set and electron correlation effects
29. Conformational energy profiles of n-butane, ethyl methyl ether and ethyl methyl sulfide Comparison of electron correlation correction procedures
30. A possible crystal structure of 1,2-dimethoxyethane: prediction based on a lattice variable molecular dynamics
31. Calculations of structures of biphenyl and alkylbiphenyls by molecular mechanics
32. Calculations of structures of styrenes and stilbenes by molecular mechanics
33. Calculations of internal rotational pathways of peri substituted naphthalenes by molecular mechanics
34. Conformation analysis of glycerides by nuclear magnetic resonance
35. Relative stability of nine candidate structures of C 84 calculated with AM1 and MM3
36. Intermolecular interaction potentials of methane and ethylene dimers calculated with the Møller–Plesset, coupled cluster and density functional methods
37. A new ab initio based model potential for methane
38. Ab initio investigation on nucleophilic ring opening of 1,3,2-oxathiaphospholane: nucleophilic substitution at phosphorus coupled with pseudorotation
39. Conformational analysis of n-alkanes using density functional theory. Comparison with ab initio calculations
40. Basis set effects on the calculated bonding energies of neutral benzene dimers: importance of diffuse polarization functions
41. Molecular dynamics simulation of supercritical carbon dioxide fluid with the model potential from ab initio molecular orbital calculations
42. Theoretical study of CH-π interaction. Significant enhancement of CD spectra due to the participation of CH-π interaction.
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