基本素養 Basic Literacy

□ 專業知能
Professional Competence
□ 工程倫理
Professional Ethics in Engineering
□ 人文關懷
Humanistic Care
□ 國際視野
International Perspective

核心能力 Competence

■ 基礎學理
Fundamental Theory
■ 專業知識
Professional Competence
■ 創新研發
Innovation and Research
■ 口頭論述及專業論文撰寫能力
Oral Discourse and thesis writing ability
□ 解決專業問題能力
Professional Issue Solved Skills
□ 工程倫理
Professional Ethics in Engineering
■ 人文素養
Quality of humanism
□ 社會關懷
Social Care
□ 跨領域知識整合能力
Interdisciplinary Knowledge Integration Ability
■ 領導管理及規劃能力
Leadership, Management and Planning Ability
■ 外語能力及國際觀
Foreign Language Ability and Global Perspective

課程概述 Course Description

1. Computational materials science –Atomic-level simulation methods 2. Mechanics vs. Thermodynamics vs.Statistical mechanics (Connection betweenquantum mechanics) 3. Monte Carlo simulations 4. Molecular dynamics simulations 5. Potentials 6. Statistical ensembles 7. Parallel computing
1. Computational materials science –Atomic-level simulation methods 2. Mechanics vs. Thermodynamics vs.Statistical mechanics (Connection betweenquantum mechanics) 3. Monte Carlo simulations 4. Molecular dynamics simulations 5. Potentials 6. Statistical ensembles 7. Parallel computing

課程學習目標 Course Objectives

  • Develop and use common computational tools
  • Understanding and using pertinent aspect of materials modeling methods
  • Becoming proficient in structured Fortran 90/95 programming
  • Learning basics of parallel programming

    • 課程進度 Progress Description

    進度說明 Progress Description
    1Introduction of Computational Materials Science
    2Fortran 基本程式教學 I
    3Fortran 基本程式教學 II
    4Fortran 基本程式教學 III
    5Fortran 基本程式教學 IV
    6Macroscopic and Microscopic system, Build-up simulation model
    7Introduction to molecular dynamics
    8Introduction to MD programming
    9Interatomic potentials
    10Molecular dynamics at constant temperature and pressure
    11MD case study I
    12MD case study II
    13Statistical Thermodynamics
    14Metropolis Monte Carlo Simulation
    15MC case study
    16Parallel Computing
    17Final project presentation
    18Final project presentation
    　以上每週進度教師可依上課情況做適度調整。The schedule may be subject to change.

    有關課程其他調查 Other Surveys of Courses

    1.本課程是否規劃業界教師參與教學或演講? 否
    Is there any industry specialist invited in this course? How many times? No
    2.本課程是否規劃含校外實習(並非參訪)? 否
    Are there any internships involved in the course? How many hours? No
    3.本課程是否可歸認為學術倫理課程? 否
    Is this course recognized as an academic ethics course? In the course how many hours are regarding academic ethics topics? No
    4.本課程是否屬進入社區實踐課程? 否
    Is this course recognized as a Community engagement and Service learning course? Which community will be engaged? No