This page captures information about our support of Prof. Andre Schleife's faculty fellowship.

Overview

Title: Computational Infrastructure for Collaborative Design of Semiconductor Nanocrystals

Link: http://www.ncsa.illinois.edu/about/fellows_awardees/computational_infrastructure_for_collaborative_design_of_semiconductor_nano

PI: Professor Andre Schleife, PhD (MatSE)

Co-PIs: Michal Ondrejcek, PhD (NCSA)

In short, the fellowship is exploring the development of the data science infrastructure that will enable a new computational/experimental approach to semiconductor nanocrystal (SNC) design.

Updates

4/23/2018

• Final Presentation by Andre

4/20/2018

• test data created without students knowing the details, run through the system and avaluate the most sensitive parameter
• script with MDF pipeline

4/06/2018

• ask Ben for the closed space on Petrel
• check GitHub repository and documentation
• ask NCSA for hosting the VM on Nebula

3/30/2018

• TBD

3/16/2018

• progress in web dashboard
• Neural network and Random forest outputs discussed
• MDF as an storage output, API, space etc.

3/9/2018

• Engineering Open House (EOH) presentations, viewing of  molecules
• 3d goggles

3/2/2018 4pm

• getting ready for EOH, 3d goggles with molecules

2/16/2018 4pm

• Matlab (Igor) code for Gaussian curves

2/2/2018 4pm

• 'dummy' Gaussian fitting predictions using Neural Network
• front end discussed
• Engineering Open House app for visualizing molecules

12/13/2017 3:30pm

• Argonne visit with Andre Schleife (presentation)

12/8/2017 3:30pm

• Gaussian fitting predictions using Random Forest discussed
• front end
• GitHub repository

12/1/2017 3:00pm

• look at the metadata (JSON) of experimental curves

11/17/2017 3:00pm

• Friday meeting

11/10/2017 3:00pm

• Friday meeting

11/7/2017 3:00pm

• Attended Faculty Fellows reception at NCSA

10/11/2017 3:00pm

• introductory meeting with Andre Schleife in MatSE

References