17 citations · 17 across the 1 of their papers we have counts for
2 papers
physics.chem-ph2023★ 17 cited
Studies on the Transcorrelated Method
Nicholas Lee, Alex J. W. Thom
We investigate the possibility of using a transcorrelated Hamiltonian to describe electron correlation. Amethod to obtain transcorrelatedwavefunctionswas developed based on the mat…
physics.chem-ph2020
Localised Spin Rotations: A Size-Consistent Approach to Non-Orthogonal Configuration Interaction
Nicholas Lee, Alex J. W. Thom
Current Non-Orthogonal Configuration Interaction (NOCI) methods often use a set of Self-Consistent Field (SCF) states selected based on chemical intuition. However, it may be chall…