화학공학소재연구정보센터

Journal of Chemical Physics

Journal of Chemical Physics, Vol.110, No.15 Entire volume, number list
ISSN: 0021-9606 (Print) 

In this Issue (56 articles)

7119 - 7122 Crossed beam reaction of the cyanogen radical, CN(X-2 Sigma(+)), with acetylene, C2H2(X-1 Sigma(+)(g)): Observation of cyanoacetylene, HCCCN(X-1 Sigma(+))
Huang LCL, Lee YT, Kaiser RI
7123 - 7126 The relativistic Dirac-Coulomb-Fock effect on atomization energies
Kedziora GS, Pople JA, Rassolov VA, Ratner MA, Redfern PC, Curtiss LA
7127 - 7128 Divergent behavior of Moller-Plesset perturbation theory for molecular electric dipole and quadrupole moments
Halkier A, Larsen H, Olsen J, Jorgensen P
7129 - 7132 An infrared study of the competition between hydrogen-bond networking and ionic solvation: Halide-dependent distortions of the water trimer in the X-center dot(H2O)(3), (X = Cl, Br, I) systems
Ayotte P, Weddle GH, Johnson MA
7133 - 7141 Decay of metastable states: Mean relaxation time formulation
Drozdov AN, Brey JJ
7142 - 7152 Noniterative algorithms for finding quantum optimal controls
Zhu WS, Rabitz H
7153 - 7159 Effect of rotation and vibration on nuclear magnetic resonance chemical shifts: Density functional theory calculations
Cromp B, Carrington T, Salahub DR, Malkina OL, Malkin VG
7160 - 7165 Soft Coulomb hole method applied to theoretical equilibrium geometries of singlet diatomic molecules
Hernandez-Laguna A, Alfonso-Mendez L, Otto P
7166 - 7175 A correlated basis set for nonadiabatic energy calculations on diatomic molecules
Kinghorn DB, Adamowicz L
7176 - 7184 The ethylene 1 B-1(1u) V state revisited
Muller T, Dallos M, Lischka H
7185 - 7191 Fluorescence excitation spectroscopic study of the jet-cooled acetyl cyanide
Yoon MC, Choi YS, Kim SK
7192 - 7201 Pump-dump control and the related transient absorption spectroscopies
Shen ZW, Yan YJ, Cheng JX, Shuang F, Zhao Y, He GZ
7202 - 7209 Theoretical study of the electronic spectrum of magnesium-porphyrin
Rubio M, Roos BO, Serrano-Andres L, Merchan M
7210 - 7215 The aurophilic attraction as interpreted by local correlation methods
Runeberg N, Schutz M, Werner HJ
7216 - 7227 Multiple-collision induced dissociation of trapped silver clusters Ag-n(+) (2 <= n <= 25)
Kruckeberg S, Dietrich G, Lutzenkirchen K, Schweikhard L, Walther C, Ziegler J
7228 - 7232 Photoionization cross sections and asymmetry parameters for silane
Machado LE, Lee MT, Brescansin LM
7233 - 7244 A four dimensional quantum scattering study of the Cl+CH4 reversible arrow HCl+CH3 reaction via spectral transform iteration
Yu HG, Nyman G
7245 - 7255 A theoretical study of five water/ammonia/formaldehyde cyclic trimers: Influence of cooperative effects
Masella M, Flament JP
7256 - 7263 Laser induced fluorescence Doppler profiles of photofragments in the presence of v-J correlation: A density matrix formalism
Chen KM, Pei CC
7264 - 7272 Nascent state distributions of NO(X (2)Pi) generated from the reaction of S(D-1) with N2O: Intramolecular vibrational-energy redistribution in the reaction intermediate
Akagi H, Fujimura Y, Kajimoto O
7273 - 7286 Fine-structure spectrum of the FO radical, observed by far-infrared laser magnetic resonance
Tamassia F, Brown JM, Evenson KM
7287 - 7297 Absorption and emission spectroscopy of perylene (C20H12) isolated in Ne, Ar, and N-2 matrices
Joblin C, Salama F, Allamandola L
7298 - 7304 Density functional, single and multireference perturbation theory study of the reaction (3)Sigma O-g(2)+HOCH2CH2 center dot -> HOO center dot+HOCH=CH2, modeling an important step in tropospheric benzene oxidation
Ghigo G, Tonachini G
7305 - 7315 Characterization of the ground (X)over-tilde (2)Pi state of the complexes R center dot SH (R = Ne, Ar, Kr)
Yang MC, Carter CC, Miller TA
7316 - 7325 Cluster birth-death processes in a vapor at equilibrium
Soto R, Cordero P
7326 - 7338 Ab initio ground potential energy surface, VTST and QCT study of the O(P-3)+CH4(X(1)A(1))-> OH(X-2 Pi)+CH3(X(2)A(2)'') reaction
Gonzalez M, Hernando J, Millan J, Sayos R
7339 - 7347 High dimensional anharmonic potential energy surfaces: The case of methane
Venuti E, Halonen L, Della Valle RG
7348 - 7353 The mean spherical approximation for a dipolar Yukawa fluid
Henderson D, Boda D, Szalai I, Chan KY
7354 - 7358 The interaction of H-2 with water ice by neutron scattering: Rotation and translation
Chen Z, Strauss HL, Loong CK
7359 - 7364 Quantum proton transfer with spatially dependent friction: Phenol-amine in methyl chloride
Antoniou D, Schwartz SD
7365 - 7375 Isomerization dynamics in viscous liquids: Microscopic investigation of the coupling and decoupling of the rate to and from solvent viscosity and dependence on the intermolecular potential
Murarka RK, Bhattacharyya S, Biswas R, Bagchi B
7376 - 7381 Quantum proton transfer coupled to a quantum anharmonic mode
Karmacharya R, Schwartz SD
7382 - 7391 Time evolution of the second derivative time-correlation-function for the depolarized light scattering spectrum of CS2
Stassen H, Steele WA
7392 - 7402 Short-range orientational correlation in the disordered crystal of 1-chloro-4-iodobenzene
Meriles CA, Perez SC, Wolfenson AE, Brunetti AH
7403 - 7411 Hydrodynamics of magnetic and dielectric fluids in interaction with the electromagnetic field
Felderhof BU, Kroh HJ
7412 - 7420 Structures of large Morse clusters
Smirnov BM, Strizhev AY, Berry RS
7421 - 7432 X-ray scattering from monolayers of F(CF2)(10)(CH2)(2)OH at the water-(hexane solution) and water-vapor interfaces
Zhang ZJ, Mitrinovic DM, Williams SM, Huang ZQ, Schlossman ML
7433 - 7442 Static structure factor of a suspension of charge-stabilized colloids: Application to liquid-glass transition phase diagram and to micellar solution
Lai SK, Wang JL, Wang GF
7443 - 7448 Mechanism of wedge effect in splitting of chemical bond by impact of X-2(-)(CO2)(n) onto silicon surface (X = Br, I)
Kalmbach U, Yasumatsu H, Koizumi S, Terasaki A, Kondow T
7449 - 7456 Soft symmetry selection rules in photoemission spectroscopy: The (1 x 2) phase of hydrogen adsorbed on Ni(110)
Birkenheuer U
7457 - 7466 The importance of self-interaction and nonlocal exchange corrections to the density functional theory of intracavity electrons in Na-doped sodalites
Blake NP, Metiu H
7467 - 7473 Spectral diffusion in glasses under high pressure: A study by time-resolved hole-burning
Lock AJ, Creemers TMH, Volker S
7474 - 7482 Dynamics of the hydrogen and phosphate ions in proton conducting gel D3PO4 electrolytes: A H-2 and P-31 nuclear magnetic resonance study
Jeffrey KR, Wieczorek W, Raducha D, Stevens JR
7483 - 7490 Density functional theory of molecular structure for thin diblock copolymer films on chemically heterogeneous surfaces
Nath SK, Nealey PF, de Pablo JJ
7491 - 7512 Free energy calculations for peptides via deterministic global optimization
Klepeis JL, Floudas CA
7513 - 7515 Polymer stretching in an elongational flow
Neumann RM
7516 - 7523 Decay rate of concentration fluctuations in microemulsions
Nonomura M, Ohta T
7524 - 7532 Analysis of the mechanical behavior of poly(trimethylene terephthalate) in an amorphous state under uniaxial extension-compression condition through atomistic modeling
Jang SS, Jo WH
7533 - 7541 Persistence length of flexible polyelectrolyte chains
Ha BY, Thirumala D
7542 - 7547 Shear influences on the phase separation of blends made of homopolymer A and random copolymer A-B
Wolf BA
7548 - 7555 Ternary surfactant mixtures in semi-infinite geometry
Tasinkevych M, Ciach A
7556 - 7573 Pressure-volume properties of endlinked hard-chain polymer networks
Kenkare NR, Hall CK, Khan SA
7574 - 7588 Many chain correlated dynamics in polymer fluids
Guenza M
7589 - 7590 Hard sphere properties obtained from a consistent closure
Lee LL
7591 - 7593 Stirring and mixing effects on oscillations and inhomogeneities in the minimal bromate oscillator
Dutt AK, Menzinger M
7594 - 7597 Comment on "On the Longuet-Higgins phase and its relation to the electronic adiabatic-diabatic transformation angle"
Kendrick BK, Mead CA, Truhlar DG