Published: On

Webinar: Harness the Power of LAMMPS Molecular Dynamics Code with MedeA®

Presented by Dr. Ray Shan

In this free webinar, you will:

  • Learn how to master the MedeA®-LAMMPS Flowchart interface and run fast, efficient simulations with the LAMMPS molecular dynamics engine
  • See what’s new in MedeA-LAMMPS in MedeA 2.22
  • Learn how to simulate a wide range of properties, including diffusivity, viscosity, thermal conductivity, and surface tension

                                                         

LAMMPS is the leading classical molecular dynamics code in the world today. Developed at Sandia National Laboratories by Dr. Steve Plimpton, LAMMPS has the widest coverage of forcefields for soft and hard materials, has the most versatile tools for applying constraints and property evaluation, and focuses on the efficient, massively parallel execution of computational tasks.

The MedeA-LAMMPS module provides flexible calculation setup and analysis capabilities to unlock the power of LAMMPS. Combined with the Transport Bundle, transport properties including diffusivity, viscosity, and thermal conductivity are at your fingertips.

 


Presenter:

Dr. Ray Shan- Support Scientist at Materials Design

Dr. Ray Shan worked alongside the LAMMPS developers Steve Plimpton and Aidan Thompson in developing and maintaining the LAMMPS molecular dynamics code for many years at Sandia National Labs in New Mexico and is an active contributor to the LAMMPS community. Ray is also an original developer of the highly regarded variable charge reactive forcefield, COMB3, and has co-authored articles on the development of REBO and ReaxFF forcefield parameters.

 

 

 


 

 

Publish while: 
2018 Jan 18 - 10 - 2018 Feb 28 - 10

News & Views

Register here to learn how high throughput calculations in the MedeA Environment can accelerate searches in your design spaces

June 24 - 28, 2018. UCLA campus, Los Angeles, California, USA

Benoit Minisini and Alexander Mavromaras will give an invited talk at the 2018 Surfair Congress in Biarritz, France May 20-22, 2018

Curious about the MedeA GUI? Watch the webinar here

Did you miss the webinar? Watch the recording here.

Click here to see the new capabilities of 2.22