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About this Symposium
Meeting 2018 TMS Annual Meeting & Exhibition
Symposium Computational Design and Simulation of Materials (CDSM 2018): Atomistic Simulations
Sponsorship Chinese Society for Metals
Organizer(s) Dallas R Trinkle, University of Illinois, Urbana-Champaign
Panthea Sepehrband, Santa Clara University
Ting Zhu, Georgia Institute of Technology
Xing-Qiu Chen, Institute of Metal Research, Chinease Academy of Sciences
Qing Jiang, Jilin University
Zi-Kui Liu, The Pennsylvania State University
Alan A. Luo, The Ohio State University
Scope This symposium will focus on simulation approaches, tools, and materials properties at the atomistic scale and will include the presentations on state-of-the-art capabilities, challenges, and future directions. Predictions of properties at both zero Kelvin and finite temperatures are of interest.

Specific topic areas for abstract submissions include (but are not limited to):

Density functional theory (DFT) for strongly correlated systems
Recent advances in quantum/classic molecular dynamics simulations
Electronic and magnetic properties from first-principle calculations
Properties at finite temperatures from first-principle calculations
Defects in materials
Interface structure and properties
Molecular dynamics simulations

This symposium is a part of the 2nd International Conference on Computational Design and Simulation of Materials.
Abstracts Due 07/16/2017
Proceedings Plan Planned: None Selected
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