Kristian Kříž

7PUBLICATIONS
6CO-AUTHORS
Theoretical quantum chemistryCondensed matter modelling and density functional theoryTransport properties and non-equilibrium processesComputational chemistryBiomolecular modelling and design
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Publications (7)

|Feb 21, 2026
Beyond Partitioning: Using Force Field Science to Evaluate Electrostatics Models.

A Najla Hosseini, Kristian Kříž, David van der Spoel

|Dec 20, 2025
Correction to "Impact of Combination Rules, Level of Theory, and Potential Function on the Modeling of Gas- and Condensed-Phase Properties of Noble Gases".

Kristian Kříž, Paul J van Maaren, David van der Spoel

|Sep 24, 2024
Quantification of Anisotropy in Exchange and Dispersion Interactions: A Simple Model for Physics-Based Force Fields.

Kristian Kříž, David van der Spoel

|Mar 13, 2024
Impact of Combination Rules, Level of Theory, and Potential Function on the Modeling of Gas- and Condensed-Phase Properties of Noble Gases.

Kristian Kříž, Paul J van Maaren, David van der Spoel

|Jan 11, 2023
An Imbalance in the Force: The Need for Standardized Benchmarks for Molecular Simulation.

Kristian Kříž, Lisa Schmidt, Alfred T Andersson

|Feb 18, 2020
Benchmarking of Semiempirical Quantum-Mechanical Methods on Systems Relevant to Computer-Aided Drug Design.

Kristian Kříž, Jan Řezáč

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Frequent Collaborators

5 joint publications

David van der Spoel

2 joint publications

Jan Řezáč

1 joint publications

Lisa Schmidt

1 joint publications

Alfred T Andersson