Jonas Greiner

Publication Activity (10 Years)

Years Active: 2020-2024
Publications (10 Years): 7

Top Topics

Density Functional Theory

Single Molecule

Top Venues

The journal of physical chemistry. A

Journal of chemical theory and computation

Physical chemistry chemical physics : PCCP

The journal of physical chemistry letters

This page only lists publications with an associated author ORCID identifier.

Publications

Jonas Greiner, Ivan Gianni, Tommaso Nottoli, Filippo Lipparini, Janus J Eriksen, Jürgen Gauss
MBE-CASSCF Approach for the Accurate Treatment of Large Active Spaces. Journal of chemical theory and computation 20 (11) (2024)
Jonas Greiner, Jürgen Gauss, Janus J Eriksen
Error Control and Automatic Detection of Reference Active Spaces in Many-Body Expanded Full Configuration Interaction. The journal of physical chemistry. A (2024)
Jonas Greiner, Jürgen Gauss, Janus J Eriksen
Error Control and Automatic Detection of Reference Active Spaces in Many-Body Expanded Full Configuration Interaction. The journal of physical chemistry. A 128 (32) (2024)
Jonas Greiner, Ivan Gianni, Tommaso Nottoli, Filippo Lipparini, Janus J Eriksen, Jürgen Gauss
MBE-CASSCF Approach for the Accurate Treatment of Large Active Spaces. Journal of chemical theory and computation (2024)
Jonas Greiner, Jürgen Gauss, Janus J Eriksen
Exploiting Non-Abelian Point-Group Symmetry to Estimate the Exact Ground-State Correlation Energy of Benzene in a Polarized Split-Valence Triple-Zeta Basis Set. The journal of physical chemistry letters (2024)
Jonas Greiner, Janus J Eriksen
Symmetrization of Localized Molecular Orbitals. The journal of physical chemistry. A (2023)
Jonas Greiner, Dage Sundholm
Calculation of vibrationally resolved absorption and fluorescence spectra of the rylenes. Physical chemistry chemical physics : PCCP 22 (4) (2020)