Daniel Kats

Scopus Author ID ResearcherID ORCID

Publication Activity (10 Years)

Years Active: 2018-2024
Publications (10 Years): 15

Top Venues

Journal of chemical theory and computation

The Journal of chemical physics

Faraday discussions

The journal of physical chemistry. A

Max Planck Institute for Solid State Research

This page only lists publications with an associated author ORCID identifier.

Affiliation History

Max Planck Institute for Solid State Research Jan 01 2018

Germany

Group Leader :: Electronic Structure Theory

Publications

Daniel Kats, Evelin Martine Christlmaier, Thomas Schraivogel, Ali Alavi
Orbital optimisation in xTC transcorrelated methods. Faraday discussions (2024)
Giovanni Li Manni, Daniel Kats, Niklas Liebermann
Resolution of Electronic States in Heisenberg Cluster Models within the Unitary Group Approach. Journal of chemical theory and computation 19 (4) (2023)
Giovanni Li Manni, Daniel Kats, Niklas Liebermann
Resolution of Electronic States in Heisenberg Cluster Models within the Unitary Group Approach. Journal of chemical theory and computation 19 (4) (2023)
Giovanni Li Manni, Daniel Kats, Niklas Liebermann
Resolution of Electronic States in Heisenberg Cluster Models within the Unitary Group Approach. Journal of chemical theory and computation (2023)
Giovanni Li Manni, Daniel Kats, Niklas Liebermann
Resolution of Electronic States in Heisenberg Cluster Models within the Unitary Group Approach. Journal of chemical theory and computation 19 (4) (2023)
Evelin Martine Christlmaier, Thomas Schraivogel, Pablo López Ríos, Ali Alavi, Daniel Kats
xTC: An efficient treatment of three-body interactions in transcorrelated methods. The Journal of chemical physics 159 (1) (2023)
Thomas Schraivogel, Evelin Martine Christlmaier, Pablo López Ríos, Ali Alavi, Daniel Kats
Transcorrelated coupled cluster methods. II. Molecular systems. The Journal of chemical physics 158 (21) (2023)
Ke Liao, Huanchen Zhai, Evelin Martine Christlmaier, Thomas Schraivogel, Pablo López Ríos, Daniel Kats, Ali Alavi
Density Matrix Renormalization Group for Transcorrelated Hamiltonians: Ground and Excited States in Molecules. Journal of chemical theory and computation (2023)
Oskar Weser, Niklas Liebermann, Daniel Kats, Ali Alavi, Giovanni Li Manni
Spin Purification in Full-CI Quantum Monte Carlo via a First-Order Penalty Approach. The journal of physical chemistry. A 126 (12) (2022)
Eugenio Vitale, Giovanni Li Manni, Ali Alavi, Daniel Kats
FCIQMC-Tailored Distinguishable Cluster Approach: Open-Shell Systems. Journal of chemical theory and computation 18 (6) (2022)
Hung-Hsuan Lin, Lorenzo Maschio, Daniel Kats, Denis Usvyat, Thomas Heine
Fragment-Based Restricted Active Space Configuration Interaction with Second-Order Corrections Embedded in Periodic Hartree-Fock Wave Function. Journal of chemical theory and computation 16 (11) (2020)
Eugenio Vitale, Ali Alavi, Daniel Kats
FCIQMC-Tailored Distinguishable Cluster Approach. Journal of chemical theory and computation 16 (9) (2020)
Yuri Alexandre Aoto, Arne Bargholz, Daniel Kats, Hans-Joachim Werner, Andreas Köhn
Perturbation Expansion of Internally Contracted Coupled-Cluster Theory up to Third Order. Journal of chemical theory and computation 15 (4) (2019)
Giovanni Li Manni, Daniel Kats, David P Tew, Ali Alavi
Role of Valence and Semicore Electron Correlation on Spin Gaps in Fe(II)-Porphyrins. Journal of chemical theory and computation 15 (3) (2019)
Daniel Kats, David P Tew
Orbital-Optimized Distinguishable Cluster Theory with Explicit Correlation. Journal of chemical theory and computation 15 (1) (2018)

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Publication Activity (10 Years)

Top Topics

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Daniel Kats