| eT 1.0: An open source electronic structure program with emphasis on coupled cluster and multilevel methods SD Folkestad, EF Kjønstad, RH Myhre, JH Andersen, A Balbi, S Coriani, ... The Journal of Chemical Physics 152 (18), 2020 | 91 | 2020 |
| An efficient algorithm for Cholesky decomposition of electron repulsion integrals SD Folkestad, EF Kjønstad, H Koch The Journal of chemical physics 150 (19), 2019 | 62 | 2019 |
| Multilevel CC2 and CCSD methods with correlated natural transition orbitals SD Folkestad, H Koch Journal of Chemical Theory and Computation 16 (1), 179-189, 2019 | 31 | 2019 |
| Equation-of-motion MLCCSD and CCSD-in-HF oscillator strengths and their application to core excitations SD Folkestad, H Koch Journal of Chemical Theory and Computation 16 (11), 6869-6879, 2020 | 23 | 2020 |
| Multilevel CC2 and CCSD in reduced orbital spaces: electronic excitations in large molecular systems SD Folkestad, EF Kjønstad, L Goletto, H Koch Journal of Chemical Theory and Computation 17 (2), 714-726, 2021 | 21 | 2021 |
| Transient resonant Auger–Meitner spectra of photoexcited thymine TJA Wolf, AC Paul, SD Folkestad, RH Myhre, JP Cryan, N Berrah, ... Faraday discussions 228, 555-570, 2021 | 15 | 2021 |
| Combining multilevel Hartree–Fock and multilevel coupled cluster approaches with molecular mechanics: a study of electronic excitations in solutions L Goletto, T Giovannini, SD Folkestad, H Koch Physical Chemistry Chemical Physics 23 (7), 4413-4425, 2021 | 15 | 2021 |
| Accelerated multimodel Newton-type algorithms for faster convergence of ground and excited state coupled cluster equations EF Kjønstad, SD Folkestad, H Koch The Journal of Chemical Physics 153 (1), 2020 | 9 | 2020 |
| New implementation of an equation-of-motion coupled-cluster damped-response framework with illustrative applications to resonant inelastic X-ray scattering AK Schnack-Petersen, T Moitra, SD Folkestad, S Coriani The Journal of Physical Chemistry A 127 (7), 1775-1793, 2023 | 7 | 2023 |
| Particle-Breaking Hartree–Fock Theory for Open Molecular Systems R Matveeva, SD Folkestad, IM Høyvik The Journal of Physical Chemistry A 127 (5), 1329-1341, 2023 | 6 | 2023 |
| Oscillator strengths in the framework of equation of motion multilevel CC3 AC Paul, SD Folkestad, RH Myhre, H Koch Journal of Chemical Theory and Computation 18 (9), 5246-5258, 2022 | 6 | 2022 |
| Predictions of pre-edge features in time-resolved near-edge X-ray absorption fine structure spectroscopy from hole–hole Tamm–Dancoff-Approximated density functional theory EG Hohenstein, JK Yu, C Bannwarth, NH List, AC Paul, SD Folkestad, ... Journal of Chemical Theory and Computation 17 (11), 7120-7133, 2021 | 6 | 2021 |
| Implementation of occupied and virtual Edmiston–Ruedenberg orbitals using Cholesky decomposed integrals SD Folkestad, R Matveeva, IM Høyvik, H Koch Journal of Chemical Theory and Computation 18 (8), 4733-4744, 2022 | 5 | 2022 |
| Linear-scaling implementation of multilevel hartree–fock theory L Goletto, EF Kjønstad, SD Folkestad, IM Høyvik, H Koch Journal of Chemical Theory and Computation 17 (12), 7416-7427, 2021 | 5 | 2021 |
| Entanglement coupled cluster theory: Exact spin-adaptation SD Folkestad, BS Sannes, H Koch The Journal of Chemical Physics 158 (22), 2023 | 3 | 2023 |
| Understanding X-ray absorption in liquid water using triple excitations in multilevel coupled cluster theory SD Folkestad, AC Paul, R Paul, S Coriani, M Odelius, M Iannuzzi, H Koch Nature Communications 15 (1), 3551, 2024 | 2 | 2024 |
| Particle-Breaking Unrestricted Hartree–Fock Theory for Open Molecular Systems R Paul née Matveeva, SD Folkestad, BS Sannes, IM Høyvik The Journal of Physical Chemistry A 128 (8), 1533-1542, 2024 | 2 | 2024 |
| Enhanced understanding of X-ray absorption in liquid water using novel coupled cluster methodologies SD Folkestad, AC Paul, R Paul, S Coriani, M Odelius, M Iannuzzi, H Koch arXiv preprint arXiv:2308.09495, 2023 | 2 | 2023 |
| Core-ionization spectrum of liquid water S Dey, SD Folkestad, AC Paul, H Koch, AI Krylov Physical Chemistry Chemical Physics 26 (3), 1845-1859, 2024 | 1 | 2024 |
| Quantum Mechanical Versus Polarizable Embedding Schemes: A Study of the Xray Absorption Spectra of Aqueous Ammonia and Ammonium SD Folkestad, AC Paul, R Paul née Matveeva, P Reinholdt, S Coriani, ... Journal of Chemical Theory and Computation 20 (10), 4161-4169, 2024 | | 2024 |
