Project Grant 2410877

Award Date 9/15/24
Completion Date 8/31/28
Dollars Obligated $785K
Federal Grant Program
47.070
Assistance Type
Project Grant
Place of Performance
Atlanta, GA 30332, USA
Similar Awards
This Project Grant award of $525,000 from the National Science Foundation (NSF) Computer and Information Science and Engineering (CISE) program will support a collaborative research project to develop a software framework that makes it easier to implement advanced quantum chemistry methods on emerging hardware. The project team from Georgia Tech, the University of Georgia, Virginia Tech, and the University of Memphis will create libraries to efficiently handle the complex matrices and tensors in...
This Project Grant award from the National Science Foundation (CFDA 47.070 - Computer and Information Science and Engineering) will provide $208,751 to the University of Memphis to develop a software framework that makes it easier to implement advanced quantum chemistry methods on emerging hardware. The project involves a collaborative team of experts in quantum chemistry and computer science from Georgia Tech, the University of Georgia, Virginia Tech, and the University of Memphis. The key...
This Project Grant awarded by the National Science Foundation (NSF) Computer and Information Science and Engineering (CISE) Federal Grant Program provides $305,000 to Virginia Polytechnic Institute & State University (Virginia Tech) to develop a software framework that will make it easier to implement advanced quantum chemistry methods on emerging hardware. The project involves a collaborative team of experts in quantum chemistry and computer science from Georgia Tech, the University of...
This Project Grant award of $309,033 from the National Science Foundation's (NSF) Computer and Information Science and Engineering (CISE) program aims to advance quantum computing software optimization techniques. The project will develop novel programming languages, compilation algorithms, and testing tools to enable more effective and efficient large-scale quantum program optimizations across diverse quantum hardware platforms, beyond traditional qubit-based systems. Key objectives include...
This $300,000 EAGER award from the National Science Foundation's (NSF) Division of Chemistry, under the Mathematical and Physical Sciences (CFDA 47.049) program, supports the development of quantum-inspired electronic structure theory methods by Virginia Polytechnic Institute & State University (Virginia Tech). The project aims to leverage ideas from quantum algorithms to create novel classical algorithms for accelerating chemistry simulations on current classical computers. The key...
This $219,933 Project Grant award from the National Science Foundation's (NSF) Computer and Information Science and Engineering (CISE) program, with a period of performance from September 1, 2025 to August 31, 2028, is for the development of "QUAIM: A Quantum Cyberinfrastructure with Automated Implementation Toolkits for Scientific Discovery." The project aims to create an open-source toolkit to enable domain scientists to leverage the power of quantum computing for complex...
This $600,000 Project Grant from the National Science Foundation's Division of Chemistry, under the Mathematical and Physical Sciences program (CFDA 47.049), will support research into practical strategies for implementing quantum chemistry on near-term quantum computers. James Freericks of Georgetown University and Dominika Zgid of the University of Michigan will collaborate to develop hybrid quantum-classical methodologies to run important parts of calculations on noisy intermediate-scale...
This Project Grant award from the National Science Foundation (NSF) Computer and Information Science and Engineering (CISE) program (CFDA 47.070) provides $300,000 to develop cyberinfrastructure products that integrate constrained nuclear-electronic orbital (CNEO) functionalities into widely used computational chemistry software packages. The project aims to implement CNEO-DFT and CNEO-MD methods as modular extensions in open-source software like PySCF, NWChem, and CP2K. These products will...
This Project Grant award from the National Science Foundation's (NSF) Computer and Information Science and Engineering (CISE) program supports a collaborative research effort led by Princeton University to expand the capabilities of the open-source Chronus Quantum (ChronusQ) software platform. The $294,053 award will enable the development of novel computational methods to simulate quantum dynamics and chemical processes with unprecedented accuracy, with applications in sustainable energy,...
This $380,000 Project Grant award from the National Science Foundation's (NSF) Computer and Information Science and Engineering (CISE) program supports the development of the QUAIM toolkit, which aims to enable scientific domain experts to seamlessly leverage the power of quantum computing. The project at George Mason University focuses on creating automated software tools to facilitate the use of quantum computers for scientific discovery in areas like computational chemistry, material science,...

This Project Grant award from the National Science Foundation (NSF) Computer and Information Science and Engineering (CISE) Federal Grant Program (CFDA 47.070) provides $784,535 to a collaborative research project led by Georgia Tech Research Corporation, in partnership with the University of Georgia, Virginia Tech, and the University of Memphis. The project aims to develop a software framework to make it easier to implement advanced quantum chemistry methods on emerging hardware. The team will create libraries to efficiently handle the complex matrices and tensors in quantum chemistry equations, and to enable programmers to implement these methods more easily. They will also develop a library to compute key electron repulsion integrals on graphics processing units. These tools will be thoroughly tested by implementing several advanced theoretical methods, including coupled-cluster, relativistic, and real-time electron dynamics techniques. The project period runs from September 15, 2024 to August 31, 2028.

Generated 8/5/25, 5:44 AM