화학공학소재연구정보센터

Journal of Physical Chemistry A

Journal of Physical Chemistry A, Vol.105, No.38 Entire volume, number list
ISSN: 1089-5639 (Print) 

In this Issue (30 articles)

8605 - 8614 Time-resolved Raman studies of photoionization of aromatic compounds in polar solvents: Picosecond relaxation dynamics of aromatic cation radicals
Nakabayashi T, Kamo S, Sakuragi H, Nishi N
8615 - 8622 Photoinduced microsecond-charge-separation in retinyl-C-60 dyad
Yamazaki M, Araki Y, Fujitsuka M, Ito O
8623 - 8628 Picosecond IR-UV pump-probe spectroscopy. IVR of OH stretching vibration of phenol and phenol dimer
Ebata T, Kayano M, Sato S, Mikami N
8629 - 8634 Time-dependent quantum dynamics study of the C plus CH reaction on the 2A' surface
Tang BY, Chen MD, Han KL, Zhang JZH
8635 - 8641 Multiphoton excited conductance spectroscopy. 1. Application of the Born model to femtosecond laser excited multiphoton ionization of nonpolar liquids
Greever JS, Turner JBM, Kauffman JF
8642 - 8645 Electronic and vibrational spectroscopy of dihydrogen bonded 2-pyridone-borane-trimethylamine complex in supersonic jets
Patwari GN, Ebata T, Mikami N
8646 - 8650 Dielectric spectroscopy of the room temperature molten salt ethylammonium nitrate
Weingartner H, Knocks A, Schrader W, Kaatze U
8651 - 8657 Structures of carbazole-(H2O)(n) (n=1-3) clusters studied by IR dip spectroscopy and a quantum chemical calculation
Sakai M, Daigoku K, Ishiuchi S, Saeki M, Hashimoto K, Fujii M
8658 - 8664 Measurement of relative product yields from the photolysis of dichlorine monoxide (Cl2O)
Smith GD, Tablas FMG, Molina LT, Molina MJ
8665 - 8671 Wavelength dependence of photooxidation vs photofragmentation of chromocene
Muraoka PT, Byun D, Zink JI
8672 - 8680 Photolysis of nitrous oxide isotopomers studied by time-dependent hermite propagation
Johnson MS, Billing GD, Gruodis A, Janssen MHM
8681 - 8690 Absolute rate constants and yields of transients from hydroxyl radical and H atom attack on glycine and methyl-substituted glycine anions
Stefanic I, Bonifacic M, Asmus KD, Armstrong DA
8691 - 8695 MALDI-TOF-MS of saturated polyolefins by coordination of metal cations: A theoretical study
Ehlers AW, de Koster CG, Meier RJ, Lammertsma K
8696 - 8708 Role of the hydrogen bonds in nitroanilines aggregation: Charge density study of 2-methyl-5-nitroaniline
Ellena J, Goeta AE, Howard JAK, Punte G
8709 - 8717 Protonation of gaseous halogenated phenols and anisoles and its interpretation using DFT-based local reactivity indices
Tishchenko O, Pham-Tran NN, Kryachko ES, Nguyen MT
8718 - 8726 A theoretical investigation of the effects of electronegative substitution on the strength of C-H center dot center dot center dot N hydrogen bonds
Wetmore SD, Schofield R, Smith DM, Radom L
8727 - 8733 Enhanced nonlinear optical response in zwitterionic molecules: A computational study on the role of orbital interactions through sigma bonds
Sitha S, Rao JL, Bhanuprakash K, Choudary BM
8734 - 8739 "Troublesome" vibrations of aromatic molecules in second-order Moller-Plesset and density functional theory calculations: Infrared spectra of phenol and phenol-OD revisited
Michalska D, Zierkiewicz W, Bienko DC, Wojciechowski W, Zeegers-Huyskens T
8740 - 8747 Energetics of uracil cation radical and anion radical ion-molecule reactions in the gas phase
Turecek F, Wolken JK
8748 - 8755 Capability of LEP-type surfaces to describe noncollinear reactions. 2. Polyatomic systems
Espinosa-Garcia J
8756 - 8762 Self-consistent reaction field calculations of aqueous Al3+, Fe3+, and Si4+: Calculated aqueous-phase deprotonation energies correlated with experimental In(K-a) and pK(a)
Kubicki JD
8763 - 8768 Density functional theory and X-ray investigations of P- and M-hexamethylene triperoxide diamine and its dialdehyde derivative
Wierzbicki A, Salter EA, Cioffi EA, Stevens ED
8769 - 8774 Ab initio study of the structures and pi* <- n electronic transition in formic acid-(water)(n) (n=3, 4, and 5) hydrogen bonded complexes
Velardez GF, Ferrero JC, Beswick JA, Daudey JP
8775 - 8781 Protonation of bipyridines and their vinylene-phenylene-vinylene derivatives: Theoretical analysis of the positive charge effects
Pan JF, Chen ZK, Chua SJ, Huang W
8782 - 8786 Diffuse-bound and valence-bound anions of cytosine
Dolgounitcheva O, Zakrzewski VG, Ortiz JV
8787 - 8793 Electronic structure of Al3On and Al3On- (n=1-3) clusters
Martinez A, Tenorio FJ, Ortiz JV
8794 - 8804 Density functional calculations on alanine-derived radicals: Influence of molecular environment on EPR hyperfine coupling constants
Pauwels E, Van Speybroeck V, Lahorte P, Waroquier M
8805 - 8814 Systematic study of the quality of various quantum similarity descriptors. Use of the autocorrelation function and principal component analysis
Boon G, Langenaeker W, De Proft F, De Winter H, Tollenaere JP, Geerlings P
8815 - 8820 Scrutiny of the HSAB principle in some representative acid-base reactions
Chattaraj PK, Gomez B, Chamorro E, Santos J, Fuentealba P
8821 - 8822 Collective electronic oscillators for second-order polarizabilities of push-pull carotenoids (vol 105A, pg 5692, 2001)
Toury T, Zyss J, Chernyak V, Mukamel S