Publications | Yusuf Hamied Department of Chemistry

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Currently displaying 23621 - 23640 of 30660 publications

Chapter 13 Biased Monte Carlo Schemes

D Frenkel, B Smit

(2002)

321

(doi: 10.1016/b978-012267351-1/50015-8)

Chapter 12 Long-Range Interactions

D Frenkel, B Smit

(2002)

291

(doi: 10.1016/b978-012267351-1/50014-6)

Chapter 11 Free Energy of Chain Molecules

D Frenkel, B Smit

(2002)

269

(doi: 10.1016/b978-012267351-1/50013-4)

Chapter 10 Free Energies of Solids

D Frenkel, B Smit

(2002)

241

(doi: 10.1016/b978-012267351-1/50012-2)

Preface

SV Ley

(2002)

27

vii

(doi: 10.1016/S1572-5995(02)80031-X)

What can classical simulators learn from ab initio simulations?

L Delle Site, RM Lyndeb-Bell, A Alavi

Journal of Molecular Liquids

(2002)

98-9

79

(doi: 10.1016/s0167-7322(01)00311-7)

Chapter 9 Other Methods to Study Coexistence

D Frenkel, B Smit

(2002)

225

(doi: 10.1016/b978-012267351-1/50011-0)

Chapter 8 The Gibbs Ensemble

D Frenkel, B Smit

(2002)

201

(doi: 10.1016/b978-012267351-1/50010-9)

Chapter 7 Free Energy Calculations

D Frenkel, B Smit

(2002)

167

(doi: 10.1016/b978-012267351-1/50009-2)

Molecular Dynamics in Various Ensembles

D Frenkel, B Smit

(2002)

139

(doi: 10.1016/b978-012267351-1/50008-0)

Monte Carlo Simulations in Various Ensembles

D Frenkel, B Smit

(2002)

111

(doi: 10.1016/b978-012267351-1/50007-9)

Structures of adsorbed water layers on MgO: an ab initio study

RM Lynden-Bell, L Delle Site, A Alavi

Surface Science

(2002)

496

L1

(doi: 10.1016/S0039-6028(01)01669-7)

Energetics of enzyme stability

M Vendruscolo

Trends Biotechnol

(2002)

20

1

(doi: 10.1016/S0167-7799(01)01871-6)

Isothermal and temperature-programmed oxidation of CH over Pt(1 1 0)-(1 × 2)

DTP Watson, JJW Harris, DA King

Surface Science

(2002)

505

58

(doi: 10.1016/S0039-6028(01)01679-X)

Coverage dependence of the dissociative sticking probability of methane on Pt(1 1 0)-(1 × 2)

DTP Watson, J van Dijk, JJW Harris, DA King

Surface Science

(2002)

506

243

(doi: 10.1016/S0039-6028(02)01315-8)

New look and new outlook

WA Hendrickson, C-I Brändén, AR Fersht

Structure

(2002)

10

1

(doi: 10.1016/s0969-2126(01)00704-3)

Molecular Dynamics Simulations

D Frenkel, B Smit

(2002)

63

(doi: 10.1016/b978-012267351-1/50006-7)

Self-assembly of porphyrin arrays

L Baldini, CA Hunterf

Advances in Inorganic Chemistry

(2002)

53

213

(doi: 10.1016/s0898-8838(02)53006-3)

New Directions: Mobile laboratory reveals new issues in urban air quality

PW Seakins, DL Lansley, A Hodgson, N Huntley, F Pope

Atmospheric Environment

(2002)

36

1247

(doi: 10.1016/s1352-2310(01)00584-2)

Chapter 3 Monte Carlo Simulations

D Frenkel, B Smit

(2002)

23

(doi: 10.1016/b978-012267351-1/50005-5)