Edward J. Maginn,
Jeffrey Errington
Springer Nature Singapore
e druk, 2022
9789813366411
Foundations of Molecular Modeling and Simulation
Select Papers from FOMMS 2018
Specificaties
Paperback, blz.
|
Engels
Springer Nature Singapore |
2022
ISBN13: 9789813366411
Rubricering
Onderdeel van serie
Molecular Modeling and Simulation
Verwachte levertijd ongeveer 9 werkdagen
Samenvatting
This highly informative and carefully presented book comprises select proceedings of Foundation for Molecular Modelling and Simulation (FOMMS 2018). The contents are written by invited speakers centered on the theme Innovation for Complex Systems. It showcases new developments and applications of computational quantum chemistry, statistical mechanics, molecular simulation and theory, and continuum and engineering process simulation. This volume will serve as a useful reference to researchers, academicians and practitioners alike.
Specificaties
ISBN13:9789813366411
Taal:Engels
Bindwijze:paperback
Uitgever:Springer Nature Singapore
Inhoudsopgave
Strain Controlling Catalytic Efficiency of Water Oxidation for Ni1-xFexOOH alloy.- The Role of Entropy in the Structural Transitions in Zeolitic Imidazolate Frameworks.- Coarse-grained modeling and simulations of thermoresponsive biopolymers and polymer nanocomposites with specific and directional interactions.- Dissipative Particle Dynamics Approaches to Modeling the Self-Assembly and Morphology of Neutral and Ionic Block Copolymers in Solution.- The Statistical Mechanics of Solution-phase Nucleation: CaCO3 Revisited.- Efficient Sampling of High-Dimensional Free Energy Landscapes: A Review of Parallel Bias Metadynamics.<br><div><br></div>