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Quantum Chemistry Common Driver and Databases (QCDB) and Quantum Chemistry Engine (QCE ngine ): Automation and interoperability among computational chemistry programs2021 The Journal of Chemical Physics article Physics and Astronomy Advanced Chemical Physics Studies Open access
Daniel G. A. Smith, Annabelle T. Lolinco, Zachary L. Glick, Jiyoung Lee, Asem Alenaizan, Taylor Barnes, +42 more
52citations -
MiMiC: Multiscale Modeling in Computational Chemistry2020 Frontiers in Molecular Biosciences article Physics and Astronomy Advanced Chemical Physics Studies Open access
Viacheslav Bolnykh, Jógvan Magnus Haugaard Olsen, Simone Meloni, Martin P. Bircher, Emiliano Ippoliti, Paolo Carloni, +1 more
10citations -
Overview on Building Blocks and Applications of Efficient and Robust Extended Tight Binding2025 The Journal of Physical Chemistry A article Physics and Astronomy Advanced Chemical Physics Studies Open access
Abylay Katbashev, Marcel Stahn, Thomas Rose, Vahideh Alizadeh, Marvin Friede, Christoph Plett, +2 more
24citations -
Swift : a modern highly parallel gravity and smoothed particle hydrodynamics solver for astrophysical and cosmological applications2024 Monthly Notices of the Royal Astronomical Society article Physics and Astronomy Galaxies: Formation, Evolution, Phenomena Open access
Matthieu Schaller, Josh Borrow, P. W. Draper, Mladen Ivković, Stuart McAlpine, Bert Vandenbroucke, +21 more
107citations -
Algorithm 1044: PyGenStability, a Multiscale Community Detection Framework with Generalized Markov Stability2024 ACM Transactions on Mathematical Software article Physics and Astronomy Complex Network Analysis Techniques Open access
Alexis Arnaudon, Dominik J. Schindler, Robert Lucien Peach, Adam Gosztolai, Maxwell Hodges, Michael T. Schaub, +1 more
11citations -
Transferring Data from a Voronoi Mesh to an Adaptive Cartesian Grid in Pursuit of Self-consistent Top-down Star Formation2025 The Astrophysical Journal article Physics and Astronomy Astrophysics and Star Formation Studies Open access
Sean C. Lewis, Brooke Polak, Mordecai‐Mark Mac Low, Stephen L. W. McMillan, Claude Cournoyer-Cloutier, Hui Li, +2 more
0citations -
Phonons from density-functional perturbation theory using the all-electron full-potential linearized augmented plane-wave method FLEUR *2023 Electronic Structure article Physics and Astronomy Advanced Chemical Physics Studies Open access
Christian-Roman Gerhorst, Alexander Neukirchen, Daniel Aaron Klüppelberg, Gustav Bihlmayer, Markus Betzinger, Gregor Michalicek, +2 more
9citations -
Analysis of Early Science observations with the CHaracterising ExOPlanets Satellite ( CHEOPS ) using pycheops2021 Monthly Notices of the Royal Astronomical Society article Physics and Astronomy Stellar, planetary, and galactic studies Open access
Pierre F L Maxted, David Ehrenreich, Thomas G Wilson, Yann Alibert, Andrew Collier Cameron, S. Hoyer, +74 more
79citations -
Data Combination: Interferometry and Single-dish Imaging in Radio Astronomy2023 Publications of the Astronomical Society of the Pacific article Physics and Astronomy Radio Astronomy Observations and Technology Open access
Adele Plunkett, A. Hacar, Lydia Moser-Fischer, D. Petry, Peter J. Teuben, Nickolas M. Pingel, +8 more
33citations -
Ultrafast Photoinduced Dynamics in 1,3-Cyclohexadiene: A Comparison of Trajectory Surface Hopping Schemes†2024 Journal of Chemical Theory and Computation article Physics and Astronomy Spectroscopy and Quantum Chemical Studies Open access
Edison X. Salazar, Maximilian F. S. J. Menger, Shirin Faraji
7citations -
Spectroscopic Diagnostics of the Mid-infrared Features of the Dark Globule DC 314.8–5.1 with the Spitzer Space Telescope2022 The Astrophysical Journal article Physics and Astronomy Astrophysics and Star Formation Studies Open access
E. Kosmaczewski, Ł. Stawarz, W. R. M. Rocha, Sachindev S. Shenoy, Agata Karska
3citations -
Galaxy clusters in the LoTSS-DR3: Catalogues and detection pipeline for diffuse radio emission2026 Springer Link (Chiba Institute of Technology) article Physics and Astronomy Radio Astronomy Observations and Technology Open access
C. Stuardi, G. Di Gennaro, A. Botteon, F. Braga, C. Gheller, F. Vazza, +16 more
0citations