The amazing growth of computational resources has made possible the modeling of complex chemical processes. To develop these models one needs to proceed from rigorous theoretical methods to approximate ones by exploiting the potential of innovative architectural features of modern concurrent processors. This book reviews some of the most advanced theoretical approaches in the field of molecular reaction dynamics in order to cope as rigorously as possible with the complexity of real systems.
The amazing growth of computational resources has made possible the modeling of complex chemical processes. To develop these models one needs to proce...
Theoretical treatment of the dynamics of chemical reactions has undergone a sp- tacular development during the last few years, prompted by the progress in experiments. Beam production, spectroscopicdetectionusinghighresolution, polarizedlasersallowing energy and angular momentum selection, etc. have advanced so much that the expe- ments now offer detailed scattering information for theory to explain and rationalize. At the same time advancesin computingand networkingtechnologiesfor heteregeneousand grid environments are giving new possibilities for theoretical studies of chemical react- ity....
Theoretical treatment of the dynamics of chemical reactions has undergone a sp- tacular development during the last few years, prompted by the progres...
Theoretical treatment of the dynamics of chemical reactions has undergone a sp- tacular development during the last few years, prompted by the progress in experiments. Beam production, spectroscopicdetectionusinghighresolution, polarizedlasersallowing energy and angular momentum selection, etc. have advanced so much that the expe- ments now offer detailed scattering information for theory to explain and rationalize. At the same time advancesin computingand networkingtechnologiesfor heteregeneousand grid environments are giving new possibilities for theoretical studies of chemical react- ity....
Theoretical treatment of the dynamics of chemical reactions has undergone a sp- tacular development during the last few years, prompted by the progres...
The natural mission of Computational Science is to tackle all sorts of human problems and to work out intelligent automata aimed at alleviating the b- den of working out suitable tools for solving complex problems. For this reason ComputationalScience, thoughoriginatingfromtheneedtosolvethemostch- lenging problems in science and engineering (computational science is the key player in the ?ght to gain fundamental advances in astronomy, biology, che- stry, environmental science, physics and several other scienti?c and engineering disciplines) is increasingly turning its attention to all ?elds...
The natural mission of Computational Science is to tackle all sorts of human problems and to work out intelligent automata aimed at alleviating the b-...
The natural mission of Computational Science is to tackle all sorts of human problems and to work out intelligent automata aimed at alleviating the b- den of working out suitable tools for solving complex problems. For this reason ComputationalScience, thoughoriginatingfromtheneedtosolvethemostch- lenging problems in science and engineering (computational science is the key player in the ?ght to gain fundamental advances in astronomy, biology, che- stry, environmental science, physics and several other scienti?c and engineering disciplines) is increasingly turning its attention to all ?elds...
The natural mission of Computational Science is to tackle all sorts of human problems and to work out intelligent automata aimed at alleviating the b-...
