Volker Blum

Publication Activity (10 Years)

Years Active: 2009-2023
Publications (10 Years): 10

Top Topics

Application Programming Interface

Basis Functions

Genetic Algorithm

Top Venues

Comput. Phys. Commun.

J. Open Source Softw.

J. Chem. Inf. Model.

Publications

Pavel V. Stishenko, Thomas W. Keal, Scott M. Woodley, Volker Blum, Benjamin Hourahine, Reinhard J. Maurer, Andrew J. Logsdail
Atomic Simulation Interface (ASI): application programming interface for electronic structure codes. J. Open Source Softw. 8 (86) (2023)
Sebastian Kokott, Iker Hurtado, Christian Vorwerk, Claudia Draxl, Volker Blum, Matthias Scheffler
GIMS: Graphical Interface for Materials Simulations. J. Open Source Softw. 6 (57) (2021)
Victor Wen-zhe Yu, Jonathan Moussa, Pavel Kus, Andreas Marek, Peter Messmer, Mina Yoon, Hermann Lederer, Volker Blum
GPU-acceleration of the ELPA2 distributed eigensolver for dense symmetric and hermitian eigenproblems. Comput. Phys. Commun. 262 (2021)
Victor Wen-zhe Yu, Carmen Campos, William Dawson, Alberto García, Ville Havu, Ben Hourahine, William P. Huhn, Mathias Jacquelin, Weile Jia, Murat Keçeli, Raul Laasner, Yingzhou Li, Lin Lin, Jianfeng Lu, Jonathan Moussa, José E. Román, Álvaro Vázquez-Mayagoitia, Chao Yang, Volker Blum
ELSI - An open infrastructure for electronic structure solvers. Comput. Phys. Commun. 256 (2020)
William P. Huhn, Björn Lange, Victor Wen-zhe Yu, Mina Yoon, Volker Blum
GPU acceleration of all-electron electronic structure theory using localized numeric atom-centered basis functions. Comput. Phys. Commun. 254 (2020)
Raul Laasner, Xiaochen Du, Aditya Tanikanti, Connor Clayton, Marco Govoni, Giulia Galli, Matti Ropo, Volker Blum
MatD^3^: A Database and Online Presentation Package for Research Data Supporting Materials Discovery, Design, and Dissemination. J. Open Source Softw. 5 (45) (2020)
Victor Wen-zhe Yu, Fabiano Corsetti, Alberto García, William P. Huhn, Mathias Jacquelin, Weile Jia, Björn Lange, Lin Lin, Jianfeng Lu, Wenhui Mi, Ali Seifitokaldani, Álvaro Vázquez-Mayagoitia, Chao Yang, Haizhao Yang, Volker Blum
ELSI: A unified software interface for Kohn-Sham electronic structure solvers. Comput. Phys. Commun. 222 (2018)
Franz Knuth, Christian Carbogno, Viktor Atalla, Volker Blum, Matthias Scheffler
All-electron formalism for total energy strain derivatives and stress tensor components for numeric atom-centered orbitals. Comput. Phys. Commun. 190 (2015)
Adriana Supady, Volker Blum, Carsten Baldauf
First-Principles Molecular Structure Search with a Genetic Algorithm. J. Chem. Inf. Model. 55 (11) (2015)
Sergey V. Levchenko, Xinguo Ren, Jürgen Wieferink, Rainer Johanni, Patrick Rinke, Volker Blum, Matthias Scheffler
Hybrid functionals for large periodic systems in an all-electron, numeric atom-centered basis framework. Comput. Phys. Commun. 192 (2015)
Thomas Auckenthaler, Volker Blum, Hans-Joachim Bungartz, Thomas Huckle, Rainer Johanni, Lukas Krämer, Bruno Lang, Hermann Lederer, Paul R. Willems
Parallel solution of partial symmetric eigenvalue problems from electronic structure calculations. Parallel Comput. 37 (12) (2011)
Volker Blum, Ralf Gehrke, Felix Hanke, Paula Havu, Ville Havu, Xinguo Ren, Karsten Reuter, Matthias Scheffler
Ab initio molecular simulations with numeric atom-centered orbitals. Comput. Phys. Commun. 180 (11) (2009)
Ville Havu, Volker Blum, Paula Havu, Matthias Scheffler
Efficient O(N) integration for all-electron electronic structure calculation using numeric basis functions. J. Comput. Phys. 228 (22) (2009)