Steven Y. Liem

University of Manchester — United Kingdom

Physics and Astronomy · Physical Sciences

18h-index1.1kcitations23works0.02yr avg
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Research Topics

Advanced Chemical Physics Studies(8), Spectroscopy and Quantum Chemical Studies(8), Protein Structure and Dynamics(3), Graphene research and applications(3), Catalytic Processes in Materials Science(3)

Publications23 total

The influence of water potential in simulation: a catabolite activator protein case study
Journal of Molecular Modeling·2019· 4 citedOpen Access
The hydration of serine: multipole moments versus point charges
Physical Chemistry Chemical Physics·2014· 23 cited
Aqueous Imidazole Solutions: A Structural Perspective from Simulations with High-Rank Electrostatic Multipole Moments
The Journal of Physical Chemistry B·2011· 28 cited
Properties of liquid water from a systematic refinement of a high-rank multipolar electrostatic potential
The Journal of Chemical Physics·2010· 44 cited
An investigation of the conductivity of peptide nanotube networks prepared by enzyme-triggered self-assembly
Nanoscale·2010· 148 cited
Simulation of liquid imidazole using a high-rank quantum topological electrostatic potential
Physical Chemistry Chemical Physics·2010· 24 citedOpen Access
Properties and 3D Structure of Liquid Water:  A Perspective from a High-Rank Multipolar Electrostatic Potential
Journal of Chemical Theory and Computation·2008· 44 cited
Room temperature ionic liquids containing low water concentrations—a molecular dynamics study
Physical Chemistry Chemical Physics·2008· 95 cited
A polarizable high‐rank quantum topological electrostatic potential developed using neural networks: Molecular dynamics simulations on the hydrogen fluoride dimer
International Journal of Quantum Chemistry·2007· 68 cited
Towards a Force Field via Quantum Chemical Topology
Research Explorer (The University of Manchester)·2005· 4 cited
Evidence from first principles calculations for a bent CO2 intermediate in the oxidation of carbon monoxide on the Cu (110) surface
The Journal of Chemical Physics·2004· 11 cited
Simulation of liquid water using a high‐rank quantum topological electrostatic potential
International Journal of Quantum Chemistry·2004· 60 cited
High-rank quantum topological electrostatic potential: Molecular dynamics simulation of liquid hydrogen fluoride
The Journal of Chemical Physics·2003· 42 cited
Pathways to dissociation of O2 on Cu (110) surface: first principles simulations
Surface Science·2000· 48 cited
Dissociation pathways of oxygen on copper (110) surface: a first principles study
Computational Materials Science·2000· 24 cited
First principles calculation of oxygen adsorption and reconstruction of Cu(110) surface
Surface Science·1998· 86 cited
Effective pairwise potential for simulations of adsorbed platinum
Molecular Physics·1995· 23 cited
Simulation study of platinum adsorption on graphite using the Sutton-Chen potential
Surface Science·1995· 55 cited
Morphology of Platinum Clusters Between Graphite Walls
Molecular Simulation·1995· 4 cited
A contact cavity-biased method for grand canonical Monte Carlo simulations
The Journal of Chemical Physics·1994· 18 cited
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Frequent Co-authors

Paul L. A. Popelier(12), J. H. R. Clarke(5), Kwong‐Yu Chan(5), Majeed S. Shaik(4), Georg Kresse(3), David Brown(2), Maurice Leslie(2), Haixia Xu(1), Apurba K. Das(1), Masaki Horie(1), Andrew M. Smith(1), Yi Luo(1), Xiaofeng Lu(1), Richard F. Collins(1), Aimin Song(1), Michael L. Turner(1), Ping Xiao(1), Ian A. Kinloch(1), Rein V. Ulijn(1), Julian H. R. Clarke(1)