10569 - 10572 |
Electron transfer to oriented molecules: Surprising steric effect in t-butyl bromide Harris SA, Brooks PR |
10573 - 10576 |
Thermodynamic regulation of actin polymerization Niranjan PS, Forbes JG, Greer SC, Dudowicz J, Freed KF, Douglas JF |
10577 - 10578 |
Relationship between kinetics and thermodynamics of supercooled liquids Mohanty U, Craig N, Fourkas JT |
10579 - 10582 |
Stability and production of positron-diatomic molecule complexes Mella M, Bressanini D, Morosi G |
10583 - 10590 |
Scaling of classical rate constants on scaled potential-energy surfaces Kim MS, Park ST, Sung BJ, Moon JH |
10591 - 10597 |
Exchange energy functionals based on the full fourth-order density matrix expansion Maximoff SN, Scuseria GE |
10598 - 10607 |
Vibration-rotation kinetic energy operators: A geometric algebra approach Pesonen J |
10608 - 10615 |
Direct semiclassical simulation of photochemical processes with semiempirical wave functions Granucci G, Persico M, Toniolo A |
10616 - 10622 |
Self-consistent field algorithms for Kohn-Sham models with fractional occupation numbers Cances E |
10623 - 10637 |
Quantum dissipative master equations: Some exact results Zhao Y, Chen GH |
10638 - 10650 |
Problematic p-benzyne: Orbital instabilities, biradical character, and broken symmetry Crawford TD, Kraka E, Stanton JF, Cremer D |
10651 - 10661 |
Exact three-dimensional quantum mechanical calculation of ozone photodissociation in the Hartley band Lin SY, Han KL, He GZ |
10662 - 10672 |
Experimental and theoretical differential cross sections for the reactions Cl+H-2/D-2 Skouteris D, Werner HJ, Aoiz FJ, Banares L, Castillo JF, Menendez M, Balucani N, Cartechini L, Casavecchia P |
10673 - 10681 |
An ab initio study of the betaine anion-dipole-bound anionic state of a model zwitterion system Rak J, Skurski P, Gutowski M |
10682 - 10694 |
The (X)over-tilde B-2(1), B-2(2), (2)A(1), and (2)A(2) states of oxygen difluoride cation (F2O+): High-level ab initio calculations and simulation of the ultraviolet photoelectron spectrum of F2O Wang DC, Chau FT, Mok DKW, Lee EPF, Beeching L, Ogden JS, Dyke JM |
10695 - 10701 |
Electronic structure studies of six-atom gold clusters Omary MA, Rawashdeh-Omary MA, Chusuei CC, Fackler JP, Bagus PS |
10702 - 10710 |
Isomerizations and relative kinetic stability of LJ(n) clusters in a carrier gas Curotto E |
10711 - 10716 |
Interpolated potential-energy surface and reaction dynamics for BH++H-2 Fuller RO, Bettens RPA, Collins MA |
10717 - 10724 |
A Drude-model approach to dispersion interactions in dipole-bound anions Wang F, Jordan KD |
10725 - 10727 |
The E-1 Sigma(+)(g) state of lithium dimer revised Jastrzebski W, Pashov A, Kowalczyk P |
10728 - 10732 |
Single vibronic level emission spectroscopy of jet-cooled HSiF and DSiF Hostutler DA, Clouthier DJ, Judge RH |
10733 - 10737 |
A theoretical study of the nitrogen clusters formed from the ions N-3(-), N-5(+), and N-5(-) Gagliardi L, Orlandi G, Evangelisti S, Roos BO |
10738 - 10748 |
Electronic structure and chemical bonding of 3d-metal dimers ScX, X=Sc-Zn Gutsev GL, Jena P, Rao BK, Khanna SN |
10749 - 10756 |
Structures, energies, and vibrational spectra of water undecamer and dodecamer: An ab initio study Lee HM, Suh SB, Kim KS |
10757 - 10767 |
Ground state electronic structures and spectra of zinc complexes of porphyrin, tetraazaporphyrin, tetrabenzoporphyrin, and phthalocyanine: A density functional theory study Nguyen KA, Pachter R |
10768 - 10772 |
(A)over-tilde (2)Pi(u) state-intermediated two-photon dissociation of CS2+ via the first channel Zhang LM, Chen J, Xu HF, Dai JH, Liu SL, Ma XX |
10773 - 10779 |
The spectrum of an octahedral molecule in a degenerate electronic state: The nu(6) fundamental band of jet-cooled V(CO)(6) Rey M, Boudon V, Loete M, Asselin P, Soulard P, Manceron L |
10780 - 10790 |
A restricted dimensionality quasiclassical trajectory study of H-2(v,0)+H-2(v ',0) Mandy ME, Rothwell TA, Martin PG |
10791 - 10797 |
Theoretical study on electronic excitation spectra of Mo and Re cluster complexes: [(Mo6Cl8)Cl-6](2-) and [(Re6S8)Cl-6](4-) Honda H, Noro T, Tanaka K, Miyoshi E |
10798 - 10804 |
Investigation of collisional quenching of CCl2 ((A)over-tilde B-1(1) and (a)over-tilde B-3(1)) by alkanes Gao YD, Pei LS, Chen Y, Chen CX |
10805 - 10810 |
Nonadiabatic g-u mixing of the F (1)Sigma(+)(g) and 2 (1)Sigma(+)(u) states of (LiLi)-Li-6-Li-7 Li L, Kasahara S, Kabir MH, Sahashi Y, Baba M, Kato H |
10811 - 10815 |
Long-range potential energy curves for the X (1)Sigma(+) and a (3)Sigma(+) states of NaRb Zemke WT, Stwalley WC |
10816 - 10834 |
The role of the ground and excited potential energy surfaces in the O(D-1 and P-3)+SiH4 reactions: A theoretical study Nguyen TL, Mebel AM, Lin SH |
10835 - 10844 |
Relative product yields in the one-photon and vibrationally mediated photolysis of isocyanic acid (HNCO) Berghout HL, Hsieh S, Crim FF |
10845 - 10853 |
Satellite transition magic-angle spinning nuclear magnetic resonance spectroscopy of half-integer quadrupolar nuclei Gan ZH |
10854 - 10859 |
Dynamics of the nuclear magnetic resonance COSY-revamped by asymmetric z-gradients (CRAZED) experiment Ramanathan C, Bowtell R |
10860 - 10871 |
Configuration interaction of Pr3+ in PrCl63- Tanner PA, Mak CSK, Faucher MD |
10872 - 10883 |
Pressure and temperature dependences of the relaxation dynamics of cresolphthalein-dimethylether: Evidence of contributions from thermodynamics and molecular interactions Paluch M, Ngai KL, Hensel-Bielowka S |
10884 - 10898 |
Wavelength selective modulation in femtosecond pump-probe spectroscopy and its application to heme proteins Rosca F, Kumar ATN, Ionascu D, Sjodin T, Demidov AA, Champion PM |
10899 - 10909 |
A nonanalytic model for the generic van der Waals equation of state and the critical behavior of simple fluids Eu BC |
10910 - 10921 |
Interaction induced effects in the nonlinear Raman response of liquid CS2: A finite field nonequilibrium molecular dynamics approach Jansen TIC, Snijders JG, Duppen K |
10922 - 10926 |
Curvature effect on surface diffusion: The nanotube Shu DJ, Gong XG |
10927 - 10931 |
Lattice-gas study of the kinetics of catalytic conversion of NO-CO mixtures on rhodium surfaces Bustos V, Gopinath CS, Unac R, Zaera F, Zgrablich G |
10932 - 10937 |
Configurational entropy for adsorbed linear species (k-mers) Roma F, Ramirez-Pastor AJ, Riccardo JL |
10938 - 10947 |
Electrolytes at charged interfaces: Pair integral equation approximations for model 2-2 electrolytes Eaton AC, Haymet ADJ |
10948 - 10953 |
Monte Carlo simulations of Ca-montmorillonite hydrates Chavez-Paez M, dePablo L, dePablo JJ |
10954 - 10962 |
Analysis of H-2 dissociation dynamics on the Pd(111) surface Crespos C, Busnengo HF, Dong W, Salin A |
10963 - 10967 |
Pattern formation and evolution in diblock copolymer thin films above the order-disorder transition Masson JL, Limary R, Green PF |
10968 - 10976 |
Exotic phase transitions in disordered globular networks Gutman L, Shakhnovich E |
10977 - 10978 |
Phase transitions in mixed adsorbed layers: Effect of repulsion between "hard squares" and "point particles" Liu DJ, Evans JW |
10979 - 10979 |
A universal formula for dispersion coefficients between alkali atoms Ahna CJ, Tang KT |
10980 - 10981 |
Comment on "Quasiresonant vibration-rotation transfer: A kinematic interpretation" [J. Chem. Phys. 111, 7697 (1999)] Miklavc A |
10982 - 10984 |
Response to "Comment on 'Quasiresonant vibration-rotation transfer: A kinematic interpretation' " [J. Chem. Phys. 114, 10980 (2001)] McCaffery AJ, Marsh RJ |
10985 - 10985 |
A full configuration interaction and coupled-cluster study of the potential-energy surfaces for the lowest singlet excited state of N-2 (vol 113, pg 6677, 2000) Larsen H, Olsen J, Jorgensen P, Christiansen O |
10986 - 10986 |
Relativistic dynamics of two spin-half particles in a homogeneous magnetic field (vol 114, pg 1478, 2001) Datta SN, Misra A |