Publications
Hartree-Fock critical nuclear charge in two-electron atoms
The Journal of Chemical Physics
(2021)
154
111103
(doi: 10.1063/5.0043105)
Generalised Nonorthogonal Matrix Elements: Unifying Wick's Theorem and the Slater-Condon Rules
(2021)
(doi: 10.48550/arxiv.2101.10944)
Energy Landscapes for Electronic Structure.
J Chem Theory Comput
(2020)
17
151
(doi: 10.1021/acs.jctc.0c00772)
Perturbation Theory in the Complex Plane: Exceptional Points and Where to Find Them
(2020)
(doi: 10.48550/arxiv.2012.03688)
Towards a Holomorphic Density Functional Theory.
Journal of Chemical Theory and Computation
(2020)
16
7400
(doi: 10.1021/acs.jctc.0c00822)
Reaching Full Correlation through Nonorthogonal Configuration Interaction: A Second-Order Perturbative Approach
J Chem Theory Comput
(2020)
16
5586
(doi: 10.1021/acs.jctc.0c00468)
Holomorphic Hartree-Fock Theory: Moving Beyond the Coulson-Fischer Point
(2020)
(doi: 10.17863/CAM.55079)
General Approach for Multireference Ground and Excited States Using Nonorthogonal Configuration Interaction
Journal of chemical theory and computation
(2019)
15
4851
(doi: 10.1021/acs.jctc.9b00441)
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