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Physical Chemistry Chemical Physics : PCCP
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June 28, 2023
ONIOM meets <b></b>: efficient, accurate, and robust multi-layer simulations across the periodic table
Christoph Plett, Abylay Katbashev, Sebastian Ehlert, et al.
The Journal of Chemical Physics
|
October 2, 2025
Submatrix and GPU-accelerated implementation of density matrix tight-binding
Abylay Katbashev, Robert Schade, Michael Lass, et al.
The Journal of Chemical Physics
|
January 2, 2026
Erratum: "Submatrix and GPU-accelerated implementation of density matrix tight-binding" [J. Chem. Phys. 163, 132501 (2025)]
Abylay Katbashev, Robert Schade, Michael Lass, et al.
The Journal of Physical Chemistry. A
|
February 27, 2025
Overview on Building Blocks and Applications of Efficient and Robust Extended Tight Binding
Abylay Katbashev, Marcel Stahn, Thomas Rose, et al.
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of 1
Search research articles
Search
Showing results (1-10 of 4) with videos related to
Sort By:
Page
of 1
Physical Chemistry Chemical Physics : PCCP
|
June 28, 2023
ONIOM meets <b></b>: efficient, accurate, and robust multi-layer simulations across the periodic table
Christoph Plett, Abylay Katbashev, Sebastian Ehlert, et al.
The Journal of Chemical Physics
|
October 2, 2025
Submatrix and GPU-accelerated implementation of density matrix tight-binding
Abylay Katbashev, Robert Schade, Michael Lass, et al.
The Journal of Chemical Physics
|
January 2, 2026
Erratum: "Submatrix and GPU-accelerated implementation of density matrix tight-binding" [J. Chem. Phys. 163, 132501 (2025)]
Abylay Katbashev, Robert Schade, Michael Lass, et al.
The Journal of Physical Chemistry. A
|
February 27, 2025
Overview on Building Blocks and Applications of Efficient and Robust Extended Tight Binding
Abylay Katbashev, Marcel Stahn, Thomas Rose, et al.
Page
of 1