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Electronic Structure Calculations at Macroscopic Scales
Presenter
- Vikram Gavini
October 3, 2012
IPAM
DFT Calculations of Stability and Mobility of Point Defects in Metals
Presenter
- Nick Kioussis
October 3, 2012
IPAM
Theory of Magnetic Impurities in Insulating and Semiconducting Oxides. Problems (and Solutions?)
Presenter
- Gianfranco Pacchioni
October 3, 2012
IPAM
Control of Nanocrystal Morphology and Assembly and Quantum Monte Carlo Method for Solvation
Presenter
- Richard Hennig
October 3, 2012
IPAM
Atomistic Modelling and Control of Defects Produced in Thin Film Growth
Presenter
- Roger Smith
October 2, 2012
IPAM
Applications of Accelerated Molecular Dynamics in Materials Science
Presenter
- Blas Uberuaga
October 2, 2012
IPAM
Modeling Material Defects with the Fragment Hamiltonian Approach
Presenter
- Steven Valone
October 1, 2012
IPAM
Atomistic Formation Mechanisms and Functionalization of Epitaxial Graphene on Transition Metal Substrates
Presenter
- Zhenyu Zhang
October 1, 2012
IPAM
An Efficient Method for Calculating Host and Defect Deformation Potential Based on the Concept of Quantum Electronic Stress
Presenter
- Feng Liu
October 1, 2012
IPAM
First-Principles Calculations of Point Defects in Semiconductors: Formation Energies, Electronic Properties, and Diffusion
Presenter
- Peter Kratzer
October 1, 2012
IPAM
Hybrid Functional Calculations of Defects in Materials for Optoelectronics and Quantum Information Science
Presenter
- Chris Van de Walle
October 1, 2012
IPAM