17 citations · 26 across the 2 of their papers we have counts for
2 papers
physics.chem-ph2024★ 9 cited
Orbital optimisation in xTC transcorrelated methods
Daniel Kats, Evelin M. C. Christlmaier, Thomas Schraivogel +1
We present a combination of the bi-orthogonal orbital optimisation framework with the recently introduced xTC version of transcorrelation. This allows us to implement non-iterative…
physics.chem-ph2023★ 17 cited
Transcorrelated coupled cluster methods. II. Molecular systems
Thomas Schraivogel, Evelin Martine Christlmaier, Pablo López Ríos +2
We demonstrate the accuracy of ground-state energies of the transcorrelated Hamiltonian, employing sophisticated Jastrow factors obtained from variational Monte Carlo, together wit…