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· 제목 : Molecular Dynamics Simulation: Fundamentals and Applications (Paperback)
· 분류 : 외국도서 > 기술공학 > 기술공학 > 기계공학
· ISBN : 9780128164198
· 쪽수 : 374쪽
· 출판일 : 2022-02-14
· 분류 : 외국도서 > 기술공학 > 기술공학 > 기계공학
· ISBN : 9780128164198
· 쪽수 : 374쪽
· 출판일 : 2022-02-14
목차
1. Fundamentals of classical molecular dynamics (MD) simulation
2. Potential energy functions
3. MD simulation control
4. Advanced quantum-mechanics MD and coarse-grained MD
5. Application of MD simulation in mechanical problems
6. Application of MD simulation in thermal problems
7. Application of MD simulation in mass transport problems
8. Application of MD simulation in molecular absorption/desorption problems
