- ORCID iD
-
0000-0003-2766-2672
Show
Sort by
-
Spin-constrained Hartree-Fock and the generator coordinate method for the 2-site Hubbard model
(2023) -
Extending Conceptual Density Functional Theory toward First-Order Reduced Density Matrices: An Open Subsystems Viewpoint on the Fukui Matrix
-
- Journal Article
- A1
- open access
Impact of conformation and intramolecular interactions on vibrational circular dichroism spectra identified with machine learning
-
Chemical response functions in (quasi-)degenerate states
-
- Journal Article
- A1
- open access
Uncovering phase transitions that underpin the flat-planes in the tilted Hubbard model using subsystems and entanglement measures
-
- Journal Article
- A1
- open access
Near-exact treatment of seniority-zero ground and excited states with a Richardson-Gaudin mean-field
-
- Journal Article
- A1
- open access
Three-dimensional fully pi-conjugated macrocycles : when 3D-aromatic and when 2D-aromatic-in-3D?
-
- Journal Article
- A1
- open access
Constrained iterative Hirshfeld charges : a variational approach
-
- Journal Article
- A1
- open access
Analyzing the behavior of spin phases in external magnetic fields by means of spin-constrained states
-
- Journal Article
- A1
- open access
Uncovering Clar's aromatic pi-sextet rule in the Hubbard model using Maximum Probability Domain Partitions