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Atomistic Simulations Computational Vibrational Spectroscopy Condensed Phase Simulations Force fields Hemoglobin Hypersonics machine learning Molecular Dynamics Molecular Simulation Multipolar Force Fields Myoglobin Nitric Oxide potential energy surfaces Proton Transfer Reactive Molecular Dynamics RKHS Spectroscopy truncated Hemoglobin vibrational relaxation Vibrational Spectroscopy

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2013
1.

P. K. Gupta; M. Meuwly

Dynamics and Vibrational Spectroscopy of Water at Hydroxylated Silica Surface Journal Article

In: Farad. Disc., vol. 167, pp. 329, 2013.

BibTeX | Tags: Hydroxylated Silica Surface, Vibrational Spectroscopy, Water