Jürg Hutter
According to our database1,
Jürg Hutter
authored at least 14 papers
between 2005 and 2022.
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Bibliography
2022
Towards electronic structure-based <i>ab-initio</i> molecular dynamics simulations with hundreds of millions of atoms.
Parallel Comput., 2022
2021
Enabling Electronic Structure-Based Ab-Initio Molecular Dynamics Simulations with Hundreds of Millions of Atoms.
CoRR, 2021
2019
DBCSR: A Library for Dense Matrix Multiplications on Distributed GPU-Accelerated Systems.
CoRR, 2019
Proceedings of the Parallel Computing: Technology Trends, 2019
2017
Increasing the Efficiency of Sparse Matrix-Matrix Multiplication with a 2.5D Algorithm and One-Sided MPI.
Proceedings of the Platform for Advanced Scientific Computing Conference, 2017
Porting of the DBCSR Library for Sparse Matrix-Matrix Multiplications to Intel Xeon Phi Systems.
Proceedings of the Parallel Computing is Everywhere, 2017
2015
Dividing a complex reaction involving a hypervalent iodine reagent into three limiting mechanisms by <i>ab initio</i> molecular dynamics.
J. Comput. Chem., 2015
Enabling simulation at the fifth rung of DFT: Large scale RPA calculations with excellent time to solution.
Comput. Phys. Commun., 2015
2014
Parallel Comput., 2014
2013
Improving Communication Performance of Sparse Linear Algebra for an Atomistic Simulation Application.
Proceedings of the Parallel Computing: Accelerating Computational Science and Engineering (CSE), 2013
2006
Proceedings of the High Performance Computing in Science and Engineering, 2006
2005
Dual-level parallelism for ab initio molecular dynamics: Reaching teraflop performance with the CPMD code.
Parallel Comput., 2005
Quickstep: Fast and accurate density functional calculations using a mixed Gaussian and plane waves approach.
Comput. Phys. Commun., 2005
Toward a Monte Carlo program for simulating vapor-liquid phase equilibria from first principles.
Comput. Phys. Commun., 2005