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Physical Review. E, Statistical Physics, Plasmas, Fluids, and Related Interdisciplinary Topics|April 24, 2002
Largest Lyapunov exponent in molecular systems. II: Quaternion coordinates and application to methane clustersF CalvoThe Journal of Chemical Physics|April 24, 2012
Molecular dynamics determination of the surface tension of silver-gold liquid alloys and the Tolman length of nanoalloysF CalvoThe Journal of Chemical Physics|June 25, 2018
Tunneling splittings from path-integral molecular dynamics using a Langevin thermostatC L Vaillant, D J Wales, S C AlthorpeFaraday Discussions|October 19, 2001
Global optimization and the energy landscapes of Dzugutov clustersJ P Doye, D J Wales, S I SimdyankinPhysical Review. E, Statistical, Nonlinear, and Soft Matter Physics|January 15, 2011
Free-energy landscapes from adaptively biased methods: application to quantum systemsF CalvoPhysical Review. E, Statistical, Nonlinear, and Soft Matter Physics|March 19, 2013
Role of inertial forces on the chaotic dynamics of flexible rotating bodiesF CalvoThe Journal of Physical Chemistry Letters|November 5, 2019
Tunneling Splittings in Water Clusters from Path Integral Molecular DynamicsC L Vaillant, D J Wales, S C AlthorpeThe Journal of Chemical Physics|June 16, 2014
Potential energy landscape of the two-dimensional XY model: higher-index stationary pointsD Mehta, C Hughes, M Kastner, et al.The Journal of Chemical Physics|August 28, 2012
Optimal covering of C60 fullerene by rare gasesS Acosta-Gutiérrez, J Bretón, J M Gomez Llorente, et al.Pageof 45