Jakob S Kottmann

Publication Activity (10 Years)

Years Active: 2017-2024
Publications (10 Years): 11

Top Topics

Density Functional Theory

Magnetic Resonance

Energy Transfer

Top Venues

Journal of chemical theory and computation

Journal of computational chemistry

Physical chemistry chemical physics : PCCP

The journal of physical chemistry letters

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

Publications

Jakob S Kottmann, Francesco Scala
Quantum Algorithmic Approach to Multiconfigurational Valence Bond Theory: Insights from Interpretable Circuit Design. Journal of chemical theory and computation (2024)
Nicolas Poirier, Jakob S Kottmann, Alán Aspuru-Guzik, Luc Mongeau, Alireza Najafi-Yazdi
Range-separated density functional theory using multiresolution analysis and quantum computing. Journal of computational chemistry (2024)
Jakob S Kottmann, Francesco Scala
Quantum Algorithmic Approach to Multiconfigurational Valence Bond Theory: Insights from Interpretable Circuit Design. Journal of chemical theory and computation 20 (9) (2024)
Nicolas Poirier, Jakob S Kottmann, Alán Aspuru-Guzik, Luc Mongeau, Alireza Najafi-Yazdi
Range-separated density functional theory using multiresolution analysis and quantum computing. Journal of computational chemistry 45 (23) (2024)
Philipp Schleich, Joseph Boen, Lukasz Cincio, Abhinav Anand, Jakob S Kottmann, Sergei Tretiak, Pavel A Dub, Alán Aspuru-Guzik
Partitioning Quantum Chemistry Simulations with Clifford Circuits. Journal of chemical theory and computation (2023)
Abhinav Anand, Philipp Schleich, Sumner Alperin-Lea, Phillip W K Jensen, Sukin Sim, Manuel Díaz-Tinoco, Jakob S Kottmann, Matthias Degroote, Artur F Izmaylov, Alán Aspuru-Guzik
A quantum computing view on unitary coupled cluster theory. Chemical Society reviews 51 (5) (2022)
Philipp Schleich, Jakob S Kottmann, Alán Aspuru-Guzik
Improving the accuracy of the variational quantum eigensolver for molecular systems by the explicitly-correlated perturbative [2] R12 - correction. Physical chemistry chemical physics : PCCP 24 (22) (2022)
Jakob S Kottmann, Abhinav Anand, Florian Häse
A feasible approach for automatically differentiable unitary coupled-cluster on quantum computers. Chemical science 12 (10) (2021)
Jakob S Kottmann, Philipp Schleich, Teresa Tamayo-Mendoza, Alán Aspuru-Guzik
Reducing Qubit Requirements while Maintaining Numerical Precision for the Variational Quantum Eigensolver: A Basis-Set-Free Approach. The journal of physical chemistry letters 12 (1) (2021)
Jakob S Kottmann, Florian A Bischoff
Coupled-Cluster in Real Space. 1. CC2 Ground State Energies Using Multiresolution Analysis. Journal of chemical theory and computation 13 (12) (2017)
Jakob S Kottmann, Florian A Bischoff
Coupled-Cluster in Real Space. 2. CC2 Excited States Using Multiresolution Analysis. Journal of chemical theory and computation 13 (12) (2017)