“Slim”Benchmark Sets for Faster MethodDevelopment
Published in Figshare • Jun 16, 2025
NobleIDNI8P11W81R98S22
Authors:,
Tim Gould (1322793)
Stefan Vuckovic (2811898)
Abstract
The construction of large benchmark sets has accelerated advancement of quantum chemistry methods, especially in density functional theory and lower-cost methods. However, these large benchmark sets can be unsuitable for cutting-edge method development, because research codes developed for fundament...
Finding related papers...
Discussions
(0)No comments yet
Be the first to share your thoughts!