Supporting Information

AIP Publishing 2026 Open access

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Authors: Vishikh Athavale, Maksim Kulichenko, Nikita S. Fedik, Sebastian Fernández-Alberti, Anders M. N. Niklasson, Sergei Tretiak
DOI: 10.60893/figshare.jcp.31009723
Cited by: 0

Abstract

Information about 1. Verifying implementation of analytical gradients 2. Wall time and peak memory benchmarking for higher excited states 3. Gradients for degenerate excited states

Fields of Study & Subjects

Advanced Chemical Physics Studies Spectroscopy and Quantum Chemical Studies Atomic and Molecular Physics

Publication details

Journal / source
AIP Publishing
Publication date
27 January 2026