Egor Trushin

9PUBLICATIONS
96CO-AUTHORS
Formal methods for softwareTheoretical quantum chemistryStatistical mechanics in chemistryIntegrable systems (classical and quantum)
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Publications (9)

|Sep 10, 2026
The Python simulations of chemistry framework: 10 years of an open-source quantum chemistry project.

|Dec 31, 2025
Analyzing the response of exchange-correlation potentials of chain-like molecules to electric fields by Kohn-Sham inversion and evaluation of the response within the random phase approximation.

Egor Trushin, Raviraj Mandalia, Andreas Görling

|Dec 09, 2025
Mixed Gaussian and plane wave basis set implementation of the random phase approximation and of σ-functionals within the program package CP2K.

Raviraj Mandalia, Egor Trushin, Frederick Stein

|May 09, 2025
Assessment of RPA and σ-functional methods for the calculation of dipole moments and static polarizabilities and hyperpolarizabilities.

Raviraj Mandalia, Steffen Fauser, Egor Trushin

|Apr 28, 2025
Highly precise values for the energy ratios underlying the Lieb-Oxford bound and the convexity conjecture for the adiabatic connection.

Steffen Fauser, Egor Trushin, Andreas Görling

|Jan 16, 2025
Kohn-Sham inversion for open-shell systems.

Jannis Erhard, Egor Trushin, Andreas Görling

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Frequent Collaborators

8 joint publications

Andreas Görling

3 joint publications

Jannis Erhard

3 joint publications

Steffen Fauser

3 joint publications

Raviraj Mandalia