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portada Forcefields for Atomistic-Scale Simulations: Materials and Applications
Type
Physical Book
Illustrated by
Publisher
Author
Language
English
Pages
398
Format
Hardcover
Dimensions
23.4x15.6x2.4 cm
Weight
0.74 kg.
ISBN13
9789811930911
Categories

Forcefields for Atomistic-Scale Simulations: Materials and Applications

Akarsh Verma (Illustrated by) · Sanjay Mavinkere Rangappa (Illustrated by) · Shigenobu Ogata (Illustrated by) · Springer · Hardcover

Forcefields for Atomistic-Scale Simulations: Materials and Applications - Verma, Akarsh ; Mavinkere Rangappa, Sanjay ; Ogata, Shigenobu

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Synopsis "Forcefields for Atomistic-Scale Simulations: Materials and Applications "

1. Introduction to Forcefields.- 2. Forcefields for characterization of metals/metal alloys.- 3. Forcefields for characterization of nuclear materials.- 4. Forcefields and Atomistic insights to study high entropy alloys.- 5. Coarse-grained forcefields for anisotropically interacting particles.- 6. Forcefields for 2D nanomaterials (Graphene and h-BN) and the universal solvent "water".- 7. Reactive forcefield (ReaxFF) for the combustion application.- 8. Reactive forcefield (ReaxFF) for the 2D nanomaterials synthesis.- 9. Forcefields and Modelling of Polymer Coatings and nanocomposites.- 10. Accelerated reactive forcefields for studying nanomaterials and polymers

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