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The ocean contains a variety of renewable energy resources, little of which has been exploited. Here, we review both tidal range and tidal stream energy, with a focus on the resource, feedbacks, and environmental interactions. The review covers a wide range of timescales of relevance to tidal energy, from fortnightly (spring-neap) and semi-diurnal variability, down to array, and device-scale turbulence. When simulating the regional tidal energy resource, and to assess environmental impacts, it is necessary to account for feedbacks between the tidal array and the resource itself. We critically review various methods for simulating energy extraction, from insights gained through theoretical studies of "tidal fences" in idealized channels, to realistic three-dimensional model studies with complex geometry and arrays of turbines represented by momentum sinks and additional turbulence due to the presence of rotors and support structures. We discuss how variability can be reduced by developing multiple (aggregated) sites with a consideration of the enhanced phase diversity offered by exploiting less energetic tidal currents. This leads to future research questions that have not yet been explored in depth at first-generation tidal sites in relatively sheltered channels (e.g., the interaction of waves with currents). Such enhanced understanding of real sea conditions, including the effects of wind and waves, leads to our other identified primary future research direction—reduced uncertainties in turbulence predictions, including the development of realistic models that simulate the interaction between ambient turbulence and the turbulence resulting from multiple wakes, and changes to system-wide hydrodynamics, water quality, and sedimentation. [ABSTRACT FROM AUTHOR]

To extract mechanistic information of activated processes, we propose to decompose potential energy and free energy differences between configurations into contributions from individual atoms, functional groups, or residues. Decomposition is achieved by calculating the mechanical work associated with the displacements and forces of each atom along a path that connects two states, i.e., following the flow of work. Specifically, we focus on decomposing energy or free energy differences along representative pathways such as minimum energy paths (MEPs) and minimum free energy paths (MFEPs), and a numerical metric is developed to quantify the required accuracy of the reaction path. A statistical mechanical analysis of energy decomposition is also presented to illustrate the generality of this approach. Decomposition along MEP and MFEP is demonstrated on two test cases to illustrate the ability to derive quantitative mechanistic information for different types of activated processes. First, the MEP of alanine dipeptide isomerization in vacuum and the MFEP of isomerization in explicit water is studied. Our analysis shows that carbonyl oxygen and amide hydrogen contribute to most of the energetic cost for isomerization and that explicit water solvation modulates the free energy landscape primarily through hydrogen bonding with these atoms. The second test case concerns the formation of tetrahedral intermediate during a transesterification reaction. Decomposition analysis shows that water molecules not only have strong stabilization effects on the tetrahedral intermediate but also constitute a sizable potential energy barrier due to their significant structural rearrangement during the reaction. We expect that the proposed method can be generally applied to develop mechanistic understanding of catalytic and biocatalytic processes and provide useful insight for strategies of molecular engineering. [ABSTRACT FROM AUTHOR]

Tidal currents are a promising source for future power generation given their periodicity and predictability. Therefore, numerical hydrodynamic models are frequently utilized for resource assessments. However, the relevant scales of the simulations and hence modeling techniques depend on the problem at hand. This paper shows the potential of the grid refinement technique for the assessment of tidal current energy for particular sites given its relatively low computational expense and high accuracy for the regions with the refined resolution. Example applications are described for mapping the tidal resources near two facilities (Portsmouth Naval Shipyard in Maine and Key West Naval Station in Florida) for possible future deployments of Marine Hydro-Kinetic technologies. The grid refinement capability in the coupled ocean-atmosphere-wave-sediment transport modeling system is used to improve the spatial resolution in the regions of interest, and has shown significant advantage over the original simulation results for the tidal power assessment. The numerical simulation results from both the original coarse grids and the refined grids are validated with measured tidal constituents at available locations. This study demonstrates how the enhancement of a model system for a regional tidal energy with grid refinement can assist with the performance of site specific resource assessments with modest computational expense. [ABSTRACT FROM AUTHOR]

The presented study reports on numerical simulations of flows in tidal channels near Rose Dhu Island, GA, which is used to identify hotspots of hydrokinetic energy and to assess the tidal stream energy potential at this site. The numerical simulations are complemented with field measurements of local current velocities and water surface heights, which are used to validate the simulations. Both velocity distributions and water surface heights as predicted by the numerical model are in good agreement with observed data. The simulations reveal a tidal asymmetry in the encompassing Ogeechee estuary with the ebb tide currents dominating over the flood tide ones. The model is able to successfully predict the distribution of discharge into the smaller creeks around Rose Dhu Island and thereby capturing the location of local hotspots of hydrokinetic energy. It is found that local hotspots do exist near the island, and the analysis suggests the maximum available annual power of 4.75 MW, with a peak estimated extraction surpassing 4 KW during Spring tides. [ABSTRACT FROM AUTHOR]

The evaluation of the Fisher information matrix for the probability density of trajectories generated by the over-damped Langevin dynamics at equilibrium is presented. The framework we developed is general and applicable to any arbitrary potential of mean force where the parameter set is now the full space dependent function. Leveraging an innovative Hermitian form of the corresponding Fokker-Planck equation allows for an eigenbasis decomposition of the time propagation probability density. This formulation motivates the use of the square root of the equilibrium probability density as the basis for evaluating the Fisher information of trajectories with the essential advantage that the Fisher information matrix in the specified parameter space is constant. This outcome greatly eases the calculation of information content in the parameter space via a line integral. In the continuum limit, a simple analytical form can be derived to explicitly reveal the physical origin of the information content in equilibrium trajectories. This methodology also allows deduction of least informative dynamics models from known or available observables that are either dynamical or static in nature. The minimum information optimization of dynamics is performed for a set of different constraints to illustrate the generality of the proposed methodology. [ABSTRACT FROM AUTHOR]