Ute Becker

2PUBLICATIONS
8CO-AUTHORS
Automated software engineeringTheoretical quantum chemistry
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Publications (2)

|May 20, 2024
Code generation in ORCA: progress, efficiency and tight integration.

Marvin H Lechner, Anastasios Papadopoulos, Kantharuban Sivalingam

|Apr 01, 2023
SparseMaps-A systematic infrastructure for reduced-scaling electronic structure methods. VI. Linear-scaling explicitly correlated N-electron valence state perturbation theory with pair natural orbital.

Yang Guo, Fabijan Pavošević, Kantharuban Sivalingam

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Kantharuban Sivalingam

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Frank Neese

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Yang Guo

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Fabijan Pavošević