Scientific Modeling and Simulations

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Scientific Modeling and Simulations edited by Sidney Yip, Tomás Diaz de la Rubia. -
VI, 402 p. online resource. - (Lecture Notes in Computational Science and Engineering, 68) Content notes : Scientific Modeling and Simulations -- A retrospective on the journal of computer-aided materials design (JCAD), 1993–2007 -- Extrapolative procedures in modelling and simulations: the role of instabilities -- Characteristic quantities and dimensional analysis -- Accuracy of models -- Multiscale simulations of complex systems: computation meets reality -- Chemomechanics of complex materials: challenges and opportunities in predictive kinetic timescales -- Tight-binding Hamiltonian from first-principles calculations -- Atomistic simulation studies of complex carbon and silicon systems using environment-dependent tight-binding potentials -- First-principles modeling of lattice defects: advancing our insight into the structure-properties relationship of ice -- Direct comparison between experiments and computations at the atomic length scale: a case study of graphene -- Shocked materials at the intersection of experiment and simulation -- Calculations of free energy barriers for local mechanisms of hydrogen diffusion in alanates -- Concurrent design of hierarchical materials and structures -- Enthalpy landscapes and the glass transition -- Advanced modulation formats for fiber optic communication systems -- Computational challenges in the search for and production of hydrocarbons -- Microscopic mechanics of biomolecules in living cells -- Enveloped viruses understood via multiscale simulation: computer-aided vaccine design -- Computational modeling of brain tumors: discrete, continuum or hybrid?. 9781402097416 * Engineering mathematics. Computer simulation. Computer science. Chemistry. Numerical and Computational Physics, Simulation. Mathematical and Computational Engineering. Simulation and Modeling. Computational Science and Engineering. Theoretical and Computational Chemistry. * Yip, Sidney., edt, http://id.loc.gov/vocabulary/relators/edtRubia, Tomás Diaz de la., edt, http://id.loc.gov/vocabulary/relators/edt * Title * Series