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2023
Jorge, Miguel and Barrera, Maria Cecilia and Milne, Andrew W. and Ringrose, Chris and Cole, Daniel J. (2023) What is the optimal dipole moment for non-polarizable models of liquids? Journal of Chemical Theory and Computation, 19 (6). pp. 1790-1804. ISSN 1549-9618
2021
Jorge, Miguel and Milne, Andrew W. and Barrera, Maria Cecilia and Gomes, José R. B. (2021) New force-field for organosilicon molecules in the liquid phase. ACS Physical Chemistry Au, 1 (1). pp. 54-69. ISSN 2694-2445
Jorge, Miguel and Gomes, José R. B. and Milne, Andrew W. (2021) Self-consistent electrostatic embedding for liquid phase polarization. Journal of Molecular Liquids, 322. 114550. ISSN 0167-7322
2018
Milne, Andrew W. and Jorge, Miguel (2018) Polarisation corrections and the hydration free energy of water. Journal of Chemical Theory and Computation. ISSN 1549-9618
Jorge, Miguel and Milne, Andrew W. and Sobek, Olivia N. and Centi, Alessia and Pérez-Sánchez, Germán and Gomes, José R. B. (2018) Modelling the self-assembly of silica-based mesoporous materials. Molecular Simulation, 44 (6). pp. 435-452. ISSN 1029-0435