Foundations of Computational Materials Modelling

Foundations of Computational Materials Modelling

@VTU COE

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What you will learn

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This course provides the necessary foundations to (a) build computational samples of crystals (b) Introduce statistical mechanics and its connection to Molecular dynamics (c) Provide enough ground in Molecular dynamics using LAMMPS

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Symmetry elements-2
Preview 12:43
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Plane groups and their Hermann-Maugin (HM) symbols
Preview 48:35
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Glide reflection; Examples of writing point group symbols; Wyckoff positions
Preview 49:00
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Generating 2D crystal with MATLAB using Bilbao crystallography website
Preview 36:14

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Symmetry of space groups
Preview 37:57
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Hernann maugin symbols of space groups
Preview 10:32
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Translational symmetry operators
Preview 29:50

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The Space groups
Preview 32:46
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Generation of crystals
Preview 53:20

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Generation of monoclinic lattice
Preview 30:26
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Introduction to Statistical Mechanica 1
Preview 38:33
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Introduction to Statistical Mechanica 2
Preview 13:46

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Introduction to sttistical mechanics-3
Preview 26:00
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Statistical mechanics-1
Preview 39:11

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Statistical mechanics 2
Preview 42:54
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Basic introduction to mechanics
Preview 40:28

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Introduction to phase space
Preview 53:56
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Introduction to phase average and time average
Preview 47:27
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Canonical ensemble; Partition function
Preview 31:43

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Basic introduction to MD
Preview 44:38
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Input script for LAMMPS 1
Preview 46:31
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Input script for LAMMPS 2
Preview 46:07

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Input script for LAMMPS 3
Preview 35:44
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Input script for LAMMPS 4
Preview 50:50
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LAMMPS exercises 1
Preview 30:41
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LAMMPS exercises 2
Preview 34:59

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LAMMPS exercises 3
Preview 26:55
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LAMMPS exercises 4
Preview 36:05

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LAMMPS exercises 5
Preview 48:59
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Meet Your Instructor
@VTU COE
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Instructor
3.2 Rating
5446 Students
800 Courses
About Instructor

VTU is one of the largest Technological Universities in India with 24 years of Tradition of excellence in Engineering & Technical Education, Research and Innovations. It came into existence in the year 1998 to cater the needs of Indian industries for trained technical manpower with practical experience and sound theoretical knowledge.

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Free

  • Course Duration
    20 h 23 m 7 s
  • Course Level
    Intermediate
  • Student Enrolled
    0
  • Language
    English
This Course Includes
  • 20 h 23 m 7 s Video Lectures
  • 0 Quizzes
  • 0 Assignments
  • 0 Downloadable Resources
  • Full Lifetime Access
  • Certificate of Completion