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Items where Department is "Faculty of Science, Engineering and Medicine > Science > Centre for Scientific Computing"
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Number of items: 6.
Journal Article
Moss, Roger W., Henshall, Paul, Arya, Farid, Shire, G. S. F., Eames, Philip C. and Hyde, T. (2018) Simulator testing of evacuated flat plate solar collectors for industrial heat and building integration. Solar Energy, 164 . pp. 109-118. doi:10.1016/j.solener.2018.02.004 ISSN 0038-092X.
Richings, Gareth and Habershon, Scott (2018) MCTDH on-the-fly : efficient grid-based quantum dynamics without pre-computed potential energy surfaces. Journal of Chemical Physics, 148 (13). 134116. doi:10.1063/1.5024869 ISSN 0021-9606.
Sosso, Gabriele C., Deringer, Volker L., Elliott, Stephen R. and CsΓ‘nyi , GΓ‘bor (2018) Understanding the thermal properties of amorphous solids using machine-learning-based interatomic potentials. Molecular Simulation, 44 (11). pp. 866-880. doi:10.1080/08927022.2018.1447107 ISSN 0892-7022.
Dataset
Buxton, Samuel J., Quigley, David and Habershon, Scott (2018) Data for The role of nuclear quantum effects in the relative stability of hexagonal and cubic ice. [Dataset] (Submitted)
Habershon, Scott, Richings, Gareth and Robertson, Christopher (2018) Data for Improved on-the-fly MCTDH simulations with many-body-potential tensor decomposition and projection diabatisation. [Dataset]
Habershon, Scott and Richtings, Gareth (2018) Data for MCTDH on-the-fly: efficient grid-based quantum dynamics without pre-computed potential energy surfaces. [Dataset] (Unpublished)