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Fractionation of isotopes among distinct molecules or phases is a quantum effect which is often exploited to obtain insights on reaction mechanisms, biochemical, geochemical, and atmospheric phenomena. Accurate evaluation of isotope ratios in atomistic sim ...
This paper presents an information--theoretical method for weighting ensemble forecasts with new information. Weighted ensemble forecasts can be used to adjust the distribution that an existing ensemble of time series represents, without modifying the valu ...
Computer simulations of biomolecules such as molecular dynamics simulations are limited by the time scale of conformational rearrangements. Several sampling techniques are available to search the multi-minima free energy landscape but most efficient, time- ...
L'agglomération parisienne se divise en deux parties très nettement distinctes, Paris intramuros, ville historique brillant par son image, et, tout autour, organisée de manière radiale, la banlieue. Si la ville de Paris veut aujourd'hui se développer, elle ...
Density functional calculations applying periodic boundary conditions have been performed to investigate adsorption and cracking of light alkanes (C 3-C 6) on zeolite H-ZSM-5. Intrinsic energy barriers were obtained from single-point calculations by applyi ...
To make successful predictions in ungauged basins (PUB) exploring how to facilitate the identification of catchment characteristics from readily available information is as important as improving the theoretical representation of different hydrological pro ...
A mixture of two amphiphiles with fluorescent head groups can be used as a sensing ensemble for the pattern-based analysis of aminoglycoside antibiotics. In buffered aqueous solution, the amphiphiles form a dynamic mixture of micellar aggregates. In the pr ...
This contribution proposes a comparative analysis of how legislation on built heritage protection and regulations on energy demands affect current 19th century housing buildings in the city of Geneva. Four measures of protection are analysed, looking at ho ...
Department of Planning & Regional Development, School of Engineering, University of Thessaly2013
The atomic structure and composition of a catalyst's surface have a major influence on its performance regarding activity and selectivity. In this respect, intermetallic compounds are promising future catalyst materials, as their surfaces exhibit small and ...
Pour la construction de leur premier site de recherche, les membres fondateurs du CERN font appel à des architectes et ingénieurs de renom: Rudolf Steiger – protagoniste majeur de l'architecture moderne en Suisse, et dont l'œuvre commune avec Max Ernst Hae ...
