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   - Trond Saue, //Does chemistry need more physics?//, Pure and Applied Chemistry, **97** (2025) 1255 ([[https://doi.org/10.1515/pac-2025-0497|article]])([[https://arxiv.org/abs/2504.19003|arXiv]])   - Trond Saue, //Does chemistry need more physics?//, Pure and Applied Chemistry, **97** (2025) 1255 ([[https://doi.org/10.1515/pac-2025-0497|article]])([[https://arxiv.org/abs/2504.19003|arXiv]])
   - Gabriele Fabbro, Jan Brandejs and Trond Saue, //Highly Accurate Expectation Values Using High-Order Relativistic Coupled Cluster Theory//, J. Phys. Chem. A **129** (2025) 6942 ([[https://doi.org/10.1021/acs.jpca.5c02844|article]])([[https://arxiv.org/abs/2504.18516|arXiv]])   - Gabriele Fabbro, Jan Brandejs and Trond Saue, //Highly Accurate Expectation Values Using High-Order Relativistic Coupled Cluster Theory//, J. Phys. Chem. A **129** (2025) 6942 ([[https://doi.org/10.1021/acs.jpca.5c02844|article]])([[https://arxiv.org/abs/2504.18516|arXiv]])
 +  - Jan Brandejs, Johann Pototschnig and Trond Saue, //Generating Coupled Cluster Code for Modern Distributed-Memory Tensor Software//, J. Chem. Theory Comput. **21** (2025) 7320 ([[https://doi.org/10.1021/acs.jctc.5c00219|article]])([[https://arxiv.org/abs/2409.06759|arXiv]])
   - Dávid Ferenc, Maen Salman and Trond Saue, //Gaussian-basis-set approach to one-loop self-energy//, Physical Review A **111** (2025) L040802 ([[https://doi.org/10.1103/PhysRevA.111.L040802|article]])([[https://arxiv.org/abs/2501.10027|arXiv]])   - Dávid Ferenc, Maen Salman and Trond Saue, //Gaussian-basis-set approach to one-loop self-energy//, Physical Review A **111** (2025) L040802 ([[https://doi.org/10.1103/PhysRevA.111.L040802|article]])([[https://arxiv.org/abs/2501.10027|arXiv]])
   - Gabriele Fabbro, Johann Pototschnig and Trond Saue, //Beyond the Dailey–Townes Model: Chemical Information from the Electric Field Gradient//, The Journal of Physical Chemistry A **129** (2025) 1006, ([[https://doi.org/10.1021/acs.jpca.4c06884|article]])([[https://arxiv.org/abs/2410.08386|arXiv]])   - Gabriele Fabbro, Johann Pototschnig and Trond Saue, //Beyond the Dailey–Townes Model: Chemical Information from the Electric Field Gradient//, The Journal of Physical Chemistry A **129** (2025) 1006, ([[https://doi.org/10.1021/acs.jpca.4c06884|article]])([[https://arxiv.org/abs/2410.08386|arXiv]])
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 === Preprints === === Preprints ===
  
 +  - Ryan Benazzouk,Maen Salman and Trond Saue, //Wichmann-Kroll vacuum polarization density in a finite Gaussian basis set//, [[https://arxiv.org/abs/2512.16569|arXiv:2512.16569]]
 +  - Jan Brandejs, Niklas Hörnblad, Edward F. Valeev, Alexander Heinecke, Jeff Hammond, Devin Matthews and Paolo Bientinesi, //Tensor Algebra Processing Primitives (TAPP): Towards a Standard for Tensor Operations//, [[https://arxiv.org/abs/2601.07827|arXiv:2601.07827]]
 +  - Per Sehlstedt, Jan Brandejs, Paolo Bientinesi and Lars Karlsson, //The Software Landscape for the Density Matrix Renormalization Group//, [[https://arxiv.org/abs/2506.12629|arXiv:2506.12629]]
   - Jan Brandejs, Trond Saue, Andre Severo Pereira Gomes, Lucas Visscher and Paolo Bientinesi: //Report on the second Toulouse Tensor Workshop// [[https://arxiv.org/abs/2602.05490|arXiv:2602.05490]]   - Jan Brandejs, Trond Saue, Andre Severo Pereira Gomes, Lucas Visscher and Paolo Bientinesi: //Report on the second Toulouse Tensor Workshop// [[https://arxiv.org/abs/2602.05490|arXiv:2602.05490]]
   - Gabriele Fabbro, Jan Brandejs and Trond Saue: //The nuclear electric quadrupole moment of 87Sr from highly accurate molecular relativistic calculations//, [[https://arxiv.org/abs/2602.00855|arXiv:2602.00855]]   - Gabriele Fabbro, Jan Brandejs and Trond Saue: //The nuclear electric quadrupole moment of 87Sr from highly accurate molecular relativistic calculations//, [[https://arxiv.org/abs/2602.00855|arXiv:2602.00855]]
public/publications.1774167312.txt.gz · Last modified: 2026/03/22 09:15 by tsaue