Carte Molecular Dynamics Study of Nano-structures Masoud Darvish Ganji

Molecular Dynamics Study of Nano-structures

Investigation of Mechanical Properties

Limbă: engleză
Legare: Carte broșată
Disponibilitate: În depozitul extern
Expediem în 5-8 zile
238.98 lei
Nowadays, by improving the abilities of computers molecular modeling has become a powerful technique...

Informații despre carte

Limbă
engleză
Legare
Carte - Carte broșată
Publicat
2016
Pagini
96
EAN
9783659925566
Enbook ID
15200294
Greutate
162
Dimensiuni
150 x 220 x 6

Descriere completă

Nowadays, by improving the abilities of computers molecular modeling has become a powerful technique in computational chemistry with ever-increasing practical interests. At the moment, using effective algorithms along with powerful processors enables us to simulate systems including thousands atoms up to several microseconds. However, finding a balance between the computational costs and reliable results still remains a challenge. Two general approaches help us to reveal the behavior of these systems: quantum mechanics and molecular dynamics calculations. Molecular dynamics (MD) studies the motion of a set of interacting atoms, molecules or particles. MD can extract experimental observables from the dynamics of the system by investigating the system motion.

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