화학공학소재연구정보센터

Journal of Physical Chemistry A

Journal of Physical Chemistry A, Vol.120, No.13 Entire volume, number list
ISSN: 1089-5639 (Print) 

In this Issue (11 articles)

2059 - 2069 Quasi-Classical Trajectory Study of Atom Diatomic Molecule Collisions in Symmetric Hyperspherical Coordinates: The F plus HCl Reaction as a Test Case
Freixas-Lemus VM, Martinez-Mesa A, Uranga-Pina L
2070 - 2077 Time-Resolved Broadband Cavity-Enhanced Absorption Spectroscopy behind Shock Waves
Matsugi A, Shiina H, Oguchi T, Takahashi K
2078 - 2088 Conformational Changes in Thiazole-2-carboxylic Acid Selectively Induced by Excitation with Narrowband Near-IR and UV Light
Halasa A, Reva I, Lapinski L, Nowak MJ, Fausto R
2089 - 2095 Dynamics of Isolated 1,8-Naphthalimide and N-Methyl-1,8-naphthalimide: An Experimental and Computational Study
Gerbich T, Schmitt HC, Fischer I, Mitric R, Petersen J
2096 - 2105 Structure and Abundance of Nitrous Oxide Complexes in Earth's Atmosphere
Salmon SR, de Lange KM, Lane JR
2106 - 2113 Heterogeneous Reduction Pathways for Hg(II) Species on Dry Aerosols: A First-Principles Computational Study
Tacey SA, Xu L, Mavrikakis M, Schauer JJ
2114 - 2127 Atomic Insight into the Lithium Storage and Diffusion Mechanism of SiO2/Al2O3 Electrodes of Lithium Ion Batteries: ReaxFF Reactive Force Field Modeling
Ostadhossein A, Kim SY, Cubuk ED, Qi Y, van Duin ACT
2128 - 2134 Performance of Density Functional Theory and Relativistic Effective Core Potential for Ru-Based Organometallic Complexes
Paranthaman S, Moon J, Kim J, Kim DE, Kim TK
2135 - 2143 Predicting Structures of Ru-Centered Dyes: A Computational Screening Tool
Fredin LA, Allison TC
2144 - 2149 Host-Guest Inclusion Complexation of alpha-Cyclodextrin and Triiodide Examined Using UV-Vis Spectrophotometry
Pursell JL, Pursell CJ
2150 - 2159 Heavy Element Effects in the Diagonal Born-Oppenheimer Correction within a Relativistic Spin-Free Hamiltonian
Imafuku Y, Abe M, Schmidt MW, Hada M