화학공학소재연구정보센터

Journal of Chemical Physics

Journal of Chemical Physics, Vol.109, No.22 Entire volume, number list
ISSN: 0021-9606 (Print) 

In this Issue (53 articles)

9645 - 9647 The bifurcation rearrangement in cyclic water clusters : Breaking and making hydrogen bonds
Brown MG, Keutsch FN, Saykally RJ
9648 - 9651 Solvent effects on the vibrational frequency of I-2(-) in size-selected I-2(-)(Ar)(n) and I-2(-)(CO2)(n) clusters
Zanni MT, Greenblatt BJ, Neumark DM
9652 - 9655 Raman spectra and calculated vibrational frequencies of size-selected C-16, C-18, and C-20 clusters
Ott AK, Rechtsteiner GA, Felix C, Hampe O, Jarrold MF, Van Duyne RP, Raghavachari K
9656 - 9659 Simultaneous observation of dipole-bound and valence electron states in pyridine tetramer anion
Han SY, Kim JH, Song JK, Kim SK
9660 - 9663 Semiempirical van der Waals/Cahn-Hilliard theory : Size dependence of the Tolman length
Granasy L
9664 - 9673 Quasisemiclassical trajectory approach its tunneling chemical reactions
Ushiyama H, Takatsuka K
9674 - 9676 A general finite-field scheme for the calculation of frequency-dependent electronic-vibrational hyperpolarizabilities
Bishop DM, Kirtman B
9677 - 9684 Molecular relativistic calculations of the electric field gradients at the nuclei in the hydrogen halides
Visscher L, Enevoldsen T, Saue T, Oddershede J
9685 - 9693 Evaluation of analytic molecular orbital derivatives and gradients using the effective valence shell Hamiltonian method
Chaudhuri RK, Stevens JE, Freed KF
9694 - 9700 Ab initio calculations with a nonspherical Gaussian basis set : Excited states of the hydrogen molecule
Detmer T, Schmelcher P, Cederbaum LS
9701 - 9712 High-resolution laser spectroscopy of NO2 just above the (X)over-tilde(2)A(1)-(A)over-tilde(2)B(2) conical intersection : Transitions of K-=0 stacks
Biesheuvel CA, Bulthuis J, Janssen MHM, Stolte S, Snijders JG
9713 - 9718 Charge-overlap effect on the electronic transitions in moderate-energy collisions between closed-shell particles with rare-gas structure
Kita S, Gotoh S, Hasegawa T, Shimakura N
9719 - 9727 Reaction dynamics of atomic chlorine with methane : Importance of methane bending and torsional excitation in controlling reactivity
Kandel SA, Zare RN
9728 - 9736 Interpolated potential energy surface and dynamics for the reactions between N(S-4) and H-3(+)((1)A(1)')
Bettens RPA, Collins MA
9737 - 9743 Electronic structure of vanadium tetramer ion studied by optical absorption spectroscopy
Minemoto S, Terasaki A, Imoto H, Kondow T
9744 - 9752 Measurement of high-frequency rotational transitions of H2O+ in its ground state by far-infrared laser magnetic resonance (LMR) spectroscopy
Murtz P, Zink LR, Evenson KM, Brown JM
9753 - 9761 Potential energy curves for the dissociation of the Rydberg NH4 radical into (NH2+H-2)
Park JK
9762 - 9771 The first electronic states of Ar-2(+) studies by high resolution photoelectron spectroscopy
Signorell R, Merkt F
9772 - 9782 Observation of the I ' (1)Pi(g) outer well state in H-2 and D-2
Reinhold E, de Lange A, Hogervorst W, Ubachs W
9783 - 9794 Quantum dynamics of unimolecular dissociation reaction HFCO -> HF+CO
Yamamoto T, Kato S
9795 - 9801 Accurately solving the electronic Schrodinger equation of atoms and molecules using explicitly correlated (r(12)-)MR-CI. II. Ground-state energies of first-row atoms and positive atomic ions
Gdanitz RJ
9802 - 9810 Ab initio dynamic dipole polarizabilities for O-2, its photoabsorption spectrum in the Schumann-Runge region, and long-range interaction coefficients for its dimer
Spelsberg D, Meyer W
9811 - 9819 Endohedral formation, energy transfer, and dissociation in collisions between Li+ and C-60
Bernshtein V, Oref I
9820 - 9830 pi-systems as lithium hydrogen bond acceptors : Some theoretical observations
Ammal SSC, Venuvanalingam P
9831 - 9842 On the B <- X transitions of expansion cooled silver halides
Stueber GJ, Foltin M, Bernstein ER
9843 - 9847 Shape of dielectric relaxation curves of ethylene glycol oligomer water mixtures
Shinyashiki N, Sudo S, Abe W, Yagihara S
9848 - 9858 Statistical theory of cluster cooling in rare gas. I. Energy transfer analysis for palladium clusters in helium
Westergren J, Gronbeck H, Rosen A, Nordholm S
9859 - 9869 The nature of the "vibrational modes" of the network-forming liquid ZnCl2
Ribeiro MCC, Wilson M, Madden PA
9870 - 9878 High-spin -> low-spin relaxation in [Zn1-xFex(6-mepy)(3-y)(py)(y)tren](PF6)(2)
Schenker S, Hauser A, Wang W, Chan IY
9879 - 9887 Nuclear magnetic resonance and molecular dynamics study of methanol up to the supercritical region
Asahi N, Nakamura Y
9888 - 9900 The Kramers problem in the energy-diffusion limited regime
Sancho JM, Romero AH, Lindenberg K
9901 - 9918 Computer simulation study of gas-liquid nucleation in a Lennard-Jones system
ten Wolde PR, Frenkel D
9919 - 9927 Numerical study of gas-liquid nucleation in partially miscible binary mixtures
ten Wolde PR, Frenkel D
9928 - 9937 Does solvation cause symmetry breaking in the I-3(-) ion in aqueous solution?
Lynden-Bell RM, Kosloff R, Ruhman S, Danovich D, Vala A
9938 - 9949 Solid-fluid equilibrium for a molecular model with short ranged directional forces
Vega C, Monson PA
9950 - 9957 Anisotropy of pump-probe absorption of the hydrated electron : A statistical model
Bratos S, Leicknam JC
9958 - 9966 Interaction induced phenomena in Raman spectra of mesogens
Yakovenko SY, Pelzl J
9967 - 9976 Surface kinetics of a nonlinear oxygen-induced (1x5)->(1x1) phase transition on Ir{100}
Ali T, Klotzer B, Walker AV, Ge Q, King DA
9977 - 9986 Self-interaction-corrected band structure calculations for intracavity electrons in electro-sodalite
Blake NP, Metiu H
9987 - 9994 Relationship between static vibrational and electronic hyperpolarizabilities of pi-conjugated push-pull molecules within the two-state valence-bond charge-transfer model
Bishop DM, Champagne B, Kirtman B
9995 - 10003 Influence of restricted environment and ionic interactions on water solvation dynamics
Pant D, Riter RE, Levinger NE
10004 - 10010 Critical embryo phase transitions in the nucleated binary glycerin carbon dioxide system
Anisimov MP, Koropchak JA, Nasibulin AG, Timoshina LV
10011 - 10014 Polymer localization in attractive random media
Baumgaertner A
10015 - 10017 Entropy-enthalpy compensation : Conformational fluctuation and induced-fit
Qian H
10018 - 10027 Segment connectivity, chain-length breathing, segmental stretch, and constraint release in reptation models. I. Theory and single-step strain predictions
Hua CC, Schieber JD
10028 - 10032 Segment connectivity, chain-length breathing, segmental stretch, and constraint release in reptation models. II. Double-step strain predictions
Hua CC, Schieber JD, Venerus DC
10033 - 10041 Crystallization of a polymer on a surface
Doye JPK, Frenkel D
10042 - 10052 Phase equilibria in binary polymer blends : Integral equation approach
Gromov DG, de Pablo JJ
10053 - 10067 Segmental motion of entangled random coil polymers studied by pulsed gradient spin echo nuclear magnetic resonance
Komlosh ME, Callaghan PT
10068 - 10074 Response of the elastic properties of colloidal crystals to phase transitions and morphological changes
Schope HJ, Decker T, Palberg T
10075 - 10081 Surface tension of amorphous polymer films
Hapke T, Patzold G, Heermann DW
10082 - 10086 The pair of soliton-like distortions in organic ferromagnetic conjugated polymers
Li ZJ, Lin HQ, An Z, Yao KL
10087 - 10095 One-electron model for photodissociation dynamics of diatomic anion
Ka J, Shin S