Main-group test set for materials science and engineering with user-friendly graphical tools for error analysis: systematic benchmark of the numerical and intrinsic errors in state-of-the-art electronic-structure approximations (2019)
Attributed to:
HIGH END COMPUTING MATERIALS CHEMISTRY CONSORTIUM
funded by
EPSRC
Abstract
No abstract provided
Bibliographic Information
Digital Object Identifier: http://dx.doi.org/10.1088/1367-2630/aaf751
Publication URI: http://dx.doi.org/10.1088/1367-2630/aaf751
Type: Journal Article/Review
Parent Publication: New Journal of Physics
Issue: 1