Publications | Yusuf Hamied Department of Chemistry

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Currently displaying 23201 - 23220 of 30214 publications

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)

Dissipative Particle Dynamics

D Frenkel, B Smit

(2002)

465

(doi: 10.1016/b978-012267351-1/50019-5)

Rare Events

D Frenkel, B Smit

(2002)

431

(doi: 10.1016/b978-012267351-1/50018-3)

Tackling Time-Scale Problems

D Frenkel, B Smit

(2002)

409

(doi: 10.1016/b978-012267351-1/50017-1)

Accelerating Monte Carlo Sampling

D Frenkel, B Smit

(2002)

389

(doi: 10.1016/b978-012267351-1/50016-x)

Biased Monte Carlo Schemes

D Frenkel, B Smit

(2002)

321

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

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)

Chapter 9 Other Methods to Study Coexistence

D Frenkel, B Smit

(2002)

225

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

The Gibbs Ensemble

D Frenkel, B Smit

(2002)

201

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

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)

Chapter 5 Monte Carlo Simulations in Various Ensembles

D Frenkel, B Smit

(2002)

111

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

Molecular Dynamics Simulations

D Frenkel, B Smit

(2002)

63

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

Chapter 3 Monte Carlo Simulations

D Frenkel, B Smit

(2002)

23

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

Chapter 2 Statistical Mechanics

D Frenkel, B Smit

(2002)

9

(doi: 10.1016/b978-012267351-1/50004-3)

Chapter 1 Introduction

D Frenkel, B Smit

(2002)

1

(doi: 10.1016/b978-012267351-1/50003-1)

OmpA: A pore or not a pore? Simulation and modeling studies

PJ Bond, JD Faraldo-Gómez, MSP Sansom

Biophysical journal

(2002)

83

763

(doi: 10.1016/s0006-3495(02)75207-7)

Modular assembly of porphyrin sandwiches as potential hosts

CA Hunter, R Tregonning

Tetrahedron

(2002)

58

691

(doi: 10.1016/s0040-4020(01)01107-3)