EEW-Journal Papers(저널논문)

Recent Items

Collection's Items (Sorted by Submit Date in Descending order): 981 to 1000 of 1148

981
Wall-mediated self-diffusion in slit and cylindrical pores

Kim, Hyungjun; Kim, Changho; Lee, Eok Kyun; Talkner, Peter; Haenggi, Peter, PHYSICAL REVIEW E, v.77, no.3, 2008-03

982
Dynamics of simple fluids confined in cylindrical pore: Effect of pore size

Kim, Hyungjun; Cho, CH; Lee, Eok Kyun, JOURNAL OF THEORETICAL COMPUTATIONAL CHEMISTRY, v.4, no.1, pp.305 - 315, 2005-03

983
Two-electron three-centered bond in side-on (eta(2)) uranyl(V) superoxo complexes

Bryantsev, VS; de Jong, WA; Cossel, KC; Diallo, Mamadou S; Goddard, WA; Groenewold, GS; Chien, W; et al, JOURNAL OF PHYSICAL CHEMISTRY A, v.112, no.26, pp.5777 - 5780, 2008-07

984
Molecular simulation of a model of dissolved organic matter

Sutton, R; Sposito, G; Diallo, Mamadou S; Schulten, HR, ENVIRONMENTAL TOXICOLOGY AND CHEMISTRY, v.24, no.8, pp.1902 - 1911, 2005-08

985
Dendritic Chelating agents. 2. U(VI) binding to poly(amidoamine) and poly(propyleneimine) dendrimers in aqueous solutions

Diallo, Mamadou S; Arasho, W; Johnson, JH; Goddard, WA, ENVIRONMENTAL SCIENCE TECHNOLOGY, v.42, no.5, pp.1572 - 1579, 2008-03

986
Cycloaddition of benzene on Si(100) and its surface conversions

Jung, Yousung; Gordon, MS, JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, v.127, no.9, pp.3131 - 3139, 2005-03

987
Auxiliary basis expansions for large-scale electronic structure calculations

Jung, Yousung; Sodt, A; Gill, PMW; Head-Gordon, M, PROCEEDINGS OF THE NATIONAL ACADEMY OF SCIENCES OF THE UNITED STATES OF AMERICA, v.102, no.19, pp.6692 - 6697, 2005-05

988
Ab initio quantum chemistry calculations on the electronic structure of heavier alkyne congeners: Diradical character and reactivity

Jung, Yousung; Brynda, M; Power, PP; Head-Gordon, M, JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, v.128, no.22, pp.7185 - 7192, 2006-06

989
Effects of ligands and spin-polarization on the preferred conformation of distannynes

Kurlancheek, W; Jung, Yousung; Head-Gordon, M, DALTON TRANSACTIONS, pp.4428 - 4435, 2008

990
Advances in methods and algorithms in a modern quantum chemistry program package

Shao, Y; Molnar, LF; Jung, Yousung; Kussmann, J; Ochsenfeld, C; Brown, ST; Gilbert, ATB; et al, PHYSICAL CHEMISTRY CHEMICAL PHYSICS, v.8, no.27, pp.3172 - 3191, 2006

991
Influence of reaction with XeF2 on surface adhesion of Al and Al2O3 surfaces

Zhang, T.; Park, JeongYoung; Huang, W.; Somorjai, G.A., APPLIED PHYSICS LETTERS, v.93, no.14, pp.0 - 0, 2008

992
pK(a) calculations of aliphatic amines, diamines, and aminoamides via density functional theory with a Poisson-Boltzmann continuum solvent model

Bryantsev, VS; Diallo, Mamadou S; Goddard, WA, JOURNAL OF PHYSICAL CHEMISTRY A, v.111, no.20, pp.4422 - 4430, 2007-05

993
Dendrimer enhanced ultrafiltration. 1. Recovery of Cu(II) from aqueous solutions using PAMAM dendrimers with ethylene diamine core and terminal NH2 groups

Diallo, Mamadou S; Christie, S; Swaminathan, P; Johnson, JH; Goddard, WA, ENVIRONMENTAL SCIENCE TECHNOLOGY, v.39, no.5, pp.1366 - 1377, 2005-03

994
Ab initio study of the effect of water adsorption on the carbon nanotube field-effect transistor

Sung, D; Hong, S; Kim, Yong-Hoon; Park, N; Kim, S; Maeng, SL; Kim, KC, APPLIED PHYSICS LETTERS, v.89, no.24, pp.443 - 448, 2006-12

995
Structures and properties of self-assembled monolayers of bistable [2]rotaxanes on Au(111) surfaces from molecular dynamics simulations validated with experiment

Jang, SS; Jang, YH; Kim, Yong-Hoon; Goddard, WA; Flood, AH; Laursen, BW; Tseng, HR; et al, JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, v.127, no.5, pp.1563 - 1575, 2005-02

996
First-principles study of the switching mechanism of [2]catenane molecular electronic devices

Kim, Yong-Hoon; Jang, SS; Jang, YH; Goddard, WA, PHYSICAL REVIEW LETTERS, v.94, no.15, 2005-04

997
Efficiency of pi-pi tunneling in [2]rotaxane molecular electronic switches

Kim, Yong-Hoon; Goddard, WA, JOURNAL OF PHYSICAL CHEMISTRY C, v.111, no.12, pp.4831 - 4837, 2007-03

998
The effect of nanocrystalline magnetite size on arsenic removal

Mayo, JT; Yavuz, Cafer T; Yean, S; Cong, L; Shipley, H; Yu, W; Falkner, J; et al, SCIENCE AND TECHNOLOGY OF ADVANCED MATERIALS, v.8, no.1-2, pp.71 - 75, 2007

999
A fast correlated electronic structure method for computing interaction energies of large van der Waals complexes applied to the fullerene-porphyrin dimer

Jung, Yousung; Head-Gordon, M, PHYSICAL CHEMISTRY CHEMICAL PHYSICS, v.8, no.24, pp.2831 - 2840, 2006

1000
Dendritic anion hosts: Perchlorate uptake by G5-NH2 poly(propyleneimine) dendrimer in water and model electrolyte solutions

Diallo, Mamadou S; Falconer, K; Johnson, JH; Goddard, WA, ENVIRONMENTAL SCIENCE TECHNOLOGY, v.41, no.18, pp.6521 - 6527, 2007-09

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