| 4607 - 4613 |
Density fitting in second-order linear-r(12) Moller-Plesset perturbation theory
Manby FR |
| 4614 - 4619 |
Unified analytical treatment of multicenter multielectron integrals of central and noncentral interaction potentials over Slater orbitals using Psi(alpha)-ETOs
Guseinov II |
| 4620 - 4628 |
Distributed dispersion: A new approach
Williams GJ, Stone AJ |
| 4629 - 4640 |
Quantum dynamical correlations: Effective potential analytic continuation approach
Horikoshi A, Kinugawa K |
| 4641 - 4654 |
Numerical implementation of some reweighted path integral methods
Predescu C, Sabo D, Doll JD |
| 4655 - 4661 |
A new approach to density matrix functional theory
Kollmar C, Hess BA |
| 4662 - 4670 |
Measurement of the cross section for H+D-2 -> HD(v(')=3,j'=0)+D as a function of angle and energy
Ayers JD, Pomerantz AE, Fernandez-Alonso F, Ausfelder F, Bean BD, Zare RN |
| 4671 - 4681 |
Observation of a HI leaving group following ultraviolet photolysis of CH2I2 in water and an ab initio investigation of the O-H insertion/HI elimination reactions of the CH2I-I isopolyhalomethane species with H2O and 2H(2)O
Li YL, Zhao C, Kwok WM, Guan X, Zuo P, Phillips DL |
| 4682 - 4688 |
Theoretical study of the potential stability of the peroxo nitrate radical
Eisfeld W, Morokuma K |
| 4689 - 4693 |
Dynamics calculations for the LiH plus H -> Li+H-2 reactions using interpolations of accurate ab initio potential energy surfaces
Kim KH, Lee YS, Ishida T, Jeung GH |
| 4694 - 4699 |
An ab initio, analytically fitted, global potential energy surface for the ground electronic state of He-3(+)
Chang DT, Gellene GI |
| 4700 - 4712 |
Isotope dependence of the O+O-2 exchange reaction: Experiment and theory
Fleurat-Lessard P, Grebenshchikov SY, Schinke R, Janssen C, Krankowsky D |
| 4713 - 4721 |
Size-dependent dynamics of a quantum solvent: Laser spectroscopy of HCN-(HD)(n) grown in helium nanodroplets
Moore DT, Miller RE |
| 4722 - 4730 |
Charge and bonding redistribution in octatetraene driven by a strong laser field: Time-dependent Hartree-Fock simulation
Suzuki M, Mukamel S |
| 4731 - 4742 |
Infrared spectra of CH3F(ortho-H-2)(n) clusters in solid parahydrogen
Yoshioka K, Anderson DT |
| 4743 - 4754 |
The 4 (3)Sigma(+) state of NaK: Potential energy curve and hyperfine structure
Burns P, Sibbach-Morgus L, Wilkins AD, Halpern F, Clarke L, Miles RD, Li L, Hickman AP, Huennekens J |
| 4755 - 4761 |
Control of bimolecular reactions: Bond-selected reaction of vibrationally excited CH3D with Cl(P-2(3/2))
Yoon S, Holiday RJ, Crim FF |
| 4762 - 4767 |
Benzene-argon triplet intermolecular potential energy surface
Cacheiro JL, Fernandez B, Koch H, Makarewicz J, Hald K, Jorgensen P |
| 4768 - 4774 |
Rotational dynamics of nondipolar probes in ethanols: How does the strength of the solute-solvent hydrogen bond impede molecular rotation?
Dutt GB, Ghanty TK |
| 4775 - 4781 |
Calorimetric study of plastically crystalline o- and m-carboranes
Yamamuro O, Hayashi M, Matsuo T, Lunkenheimer P |
| 4782 - 4789 |
Transport properties of dimethyl sulfoxide aqueous solutions
Nieto-Draghi C, Avalos JB, Rousseau B |
| 4790 - 4797 |
An analysis of molecular origin of vibrational energy transfer from solute to solvent based upon path integral influence functional theory
Mikami T, Okazaki S |
| 4798 - 4810 |
A mode-coupling theory of diffusion in supercritical fluids
Egorov SA |
| 4811 - 4816 |
Mode bifurcation by pouring water into a cup
Kitahata H, Yamada A, Nakata S |
| 4817 - 4826 |
Deficiency of the Coulomb-field approximation in the generalized Born model: An improved formula for Born radii evaluation
Grycuk T |
| 4827 - 4832 |
Integral equation theory of penetrable sphere fluids: A modified Verlet bridge function approach
Choudhury N, Ghosh SK |
| 4833 - 4841 |
The performance of phase modulated heteronuclear dipolar decoupling schemes in fast magic-angle-spinning nuclear magnetic resonance experiments
De Paepe G, Lesage A, Emsley L |
| 4842 - 4856 |
Ion pairing in model electrolytes: A study via three-particle correlation functions
Jimenez-Angeles F, Messina R, Holm C, Lozada-Cassou M |
| 4857 - 4864 |
Perfluorinated phthalocyanines for optical limiting: Evidence for the direct correlation between substituent electron withdrawing character and the nonlinear optical effect
Dini D, Yang GY, Hanack M |
| 4865 - 4872 |
Energetics, vibrational spectrum, and scanning tunneling microscopy images for the intermediate in water production reaction on Pt(111) from density functional calculations
Karlberg GS, Olsson FE, Persson M, Wahnstrom G |
| 4873 - 4878 |
Effect of compressed CO2 on the properties of AOT reverse micelles studied by spectroscopy and phase behavior
Liu DX, Zhang JL, Han BX, Fan JF, Mu TC, Liu ZM, Wu WZ, Chen J |
| 4879 - 4886 |
Reaction intermediates in the oxidation of methanol on a Pt(111)-(2x2)O surface
Liu ZX, Sawada T, Takagi N, Watanabe K, Matsumoto Y |
| 4887 - 4890 |
The correlation between film thickness and adsorbate line shape in surface enhanced infrared absorption
Priebe A, Sinther M, Fahsold G, Pucci A |
| 4891 - 4904 |
Ultrafast relaxation dynamics of the one-dimensional molecular chain: The time-resolved spontaneous emission and exciton coherence
Tanaka S |
| 4905 - 4915 |
Oxidation of the 3x3 6H-SiC (0001) adatom cluster: A periodic density functional theory and dynamic rocking beam analysis
Xie XN, Loh KP, Yakolev N, Yang SW, Wu P |
| 4916 - 4922 |
Collision dynamics of large water clusters on graphite
Tomsic A, Andersson PU, Markovic N, Pettersson JBC |
| 4923 - 4928 |
Current-voltage characteristics of single molecular junction: Dimensionality of metal contacts
Wang CK, Luo Y |
| 4929 - 4933 |
Potential model for tetrathiafulvalene based on inelastic neutron scattering and Raman spectra
Burns GR, Favier F, Jones DJ, Roziere J, Kearley GJ |
| 4934 - 4939 |
Ab initio simulation of H2S adsorption on the (100) surface of pyrite
Stirling A, Bernasconi M, Parrinello M |
| 4940 - 4944 |
Role of supersecondary structural elements in protein G folding
Derreumaux P |
| 4945 - 4952 |
Micelle formation in a dilute solution of block copolymers with a polyelectrolyte block complexed with oppositely charged linear chains
Kramarenko EY, Khokhlov AR, Reineker P |
| 4953 - 4961 |
New surfactants design for CO2 applications: Molecular dynamics simulations of fluorocarbon-hydrocarbon oligomers
Kirmizialtin S, Menceloglu YZ, Baysal C |
| 4962 - 4970 |
Conformational statistics of bent semiflexible polymers
Zhou Y, Chirikjian GS |
| 4971 - 4985 |
Many-body interactions and the melting of colloidal crystals
Dobnikar J, Chen Y, Rzehak R, von Grunberg HH |
| 4986 - 4987 |
Formation of dipole-bound negative ions in Rydberg atom collisions: A signature
Parthasarathy R, Suess L, Liu Y, Dunning FB |
| 4988 - 4990 |
Information entropy production in non-Markovian systems
Bag BC |
