J. Rabone

发表

CO2 selectivity of a 1D microporous adenine-based metal-organic framework synthesised in water.

Kyriakos C. Stylianou, S. Chong, K. Stylianou, 2011, Chemical communications.

Dimensionality transformation through paddlewheel reconfiguration in a flexible and porous Zn-based metal-organic framework.

Kyriakos C. Stylianou, S. Chong, K. Thomas, 2012, Journal of the American Chemical Society.

A flexible metal–organic framework: Guest molecules controlled dynamic gas adsorption

S. Dai, Yanfeng Yue, S. Mahurin, 2015 .

Predicting the phospholipophilicity of monoprotic positively charged amines.

Joop L. M. Hermens, J. Hermens, G. Hodges, 2017, Environmental science. Processes & impacts.

Phospholipophilicity of CxHyN(+) amines: chromatographic descriptors and molecular simulations for understanding partitioning into membranes.

J. Hermens, G. Hodges, S. Gutsell, 2016, Environmental science. Processes & impacts.

A computational investigation of stoichiometric and calcium-deficient oxy- and hydroxy-apatites.

N. D. de Leeuw, J. Rabone, J. Bowe, 2007, Faraday discussions.

Silver and cesium diffusion dynamics at the β-SiC Σ5 grain boundary investigated with density functional theory molecular dynamics and metadynamics.

E. López‐Honorato, P. Van Uffelen, J. Rabone, 2014, The journal of physical chemistry. A.

A DFT investigation of the interactions of Pd, Ag, Sn, and Cs with silicon carbide

A. Kovács, J. Rabone, 2014 .

Iterated Reaction Graphs: Simulating Complex Maillard Reaction Pathways

Jos Tissen, Shail Patel, Jeremy Rabone, 2001, J. Chem. Inf. Comput. Sci..

Hg-supported phospholipid monolayer as rapid screening device for low molecular weight narcotic compounds in water.

G. Hodges, S. Gutsell, A. Nelson, 2019, Analytica chimica acta.

A procedure for bypassing metastable states in local basis set DFT+U calculations and its application to uranium dioxide surfaces

M. Krack, J. Rabone, 2013 .

DFT-based Metadynamics simulation of proton diffusion in tetragonal zirconia at 1500 K

P. V. Uffelen, J. Rabone, 2015 .

Multi-scale modelling of solute partition equilibria of micelle-water and microemulsion-water systems using molecular dynamics and COSMOtherm

M. Turchi, Q. Cai, G. Lian, 2017 .

Steam flows in concrete cracks: Design of an experiment

C. La Borderie, J. Rabone, 2022, Nuclear Engineering and Design.

An Adaptable Peptide-Based Porous Material

Kyriakos C. Stylianou, S. Chong, Yanfeng Yue, 2010, Science.

Potential routes to carbon inclusion in apatite minerals: a DFT study

N. H. Leeuw, J. Rabone, J. Rabone, 2007 .