Title:
AI for simulation and design of nanocatalytic materials
Agreement Value:
$237,600.00
Agreement Date:
Mar 25, 2020 - Mar 24, 2023
Description:
Modern technological materials are typically multi-component compounds with complex structures that determine their opto/electronic/chemical properties. The design of new functional materials has been greatly assisted by developments in efficient and accurate electronic-structure methodologies, most notably Density Functional Theory (DFT). But DFT is too expensive to perform the rapid screening of thousands of candidates required for the design of new high-performance materials. This project aims to harness the power of modern Artificial Intelligence to build on the success of DFT and ferret out optimal design parameters. This project is of prime socioeconomic importance, aiming to reduce the environmental footprint of the Alberta oil sands by designing new nanocatalysts for the chemical reactions involved in in-the-reservoir upgrading.
Organization:
National Research Council Canada
Expected Results:
In the short term, anticipated outcomes will be strengthened collaborations across industry, academia, and government to support research excellence. In the medium term, anticipated outcomes will be the development of new and potentially disruptive technologies with collaborators. In the long term, find collaborative solutions to public policy challenges and create stronger innovation systems.
Location:
Calgary, Alberta, CA T2N 1N4
Reference Number:
172-2021-2022-Q3-947408
Report Type:
Grants and Contributions
Recipient Business Number:
108102864
Additional Information:
This agreement has been amended 1 time(s). The total amended value is $237,600 dollars and the end date of this agreements has been modified by 358 days.
Amendment Date
Dec 10, 2021
Recipient's Legal Name:
The Governors of the University of Calgary
Federal Riding Name:
Calgary Confederation
Federal Riding Number:
48005
Program:
Collaborative Science, Technology and Innovation Program - Collaborative R&D Initiatives
Program Purpose:
Collaborate on multiparty research and development programs to catalyze transformative, high-risk, high-reward research with the potential for game-changing scientific discoveries and technological breakthroughs in priority areas.