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Employment (1)

Paderborn University: Paderborn, Nordrhein-Westfalen, DE

2019-01-01 to present | scientific advisor for chemistry and physics (Paderborn Center for Parallel Computing)
Employment
Source: Self-asserted source
Robert Schade

Works (15)

PHOENIX -- Paderborn highly optimized and energy efficient solver for two-dimensional nonlinear Schrödinger equations with integrated extensions

2024 | Journal article
DOI: 10.48550/ARXIV.2411.18341
Contributors: Jan Wingenbach; David Bauch; Xuekai Ma; Robert Schade; Christian Plessl; Stefan Schumacher
Source: Self-asserted source
Robert Schade

Scalable quantum detector tomography by high-performance computing

2024 | Journal article
DOI: 10.48550/ARXIV.2404.02844
Contributors: Timon Schapeler; Robert Schade; Michael Lass; Christian Plessl; Tim J. Bartley
Source: Self-asserted source
Robert Schade

Noctua2 Supercomputer

Journal of large-scale research facilities JLSRF
2024-04-26 | Journal article
DOI: 10.17815/jlsrf-8-187
Part of ISSN: 2364-091X
Contributors: Carsten Bauer; Tobias Kenter; Michael Lass; Lukas Mazur; Marius Meyer; Holger Nitsche; Heinrich Riebler; Robert Schade; Michael Schwarz; Nils Winnwa et al.
Source: Self-asserted source
Robert Schade

Roadmap on electronic structure codes in the exascale era

Modelling and Simulation in Materials Science and Engineering
2023-09-01 | Journal article | Author
DOI: 10.1088/1361-651x/acdf06
Part of ISSN: 0965-0393
Part of ISSN: 1361-651X
Contributors: Vikram Gavini; Stefano Baroni; Volker Blum; David Bowler; Alexander Buccheri; James Chelikowsky; Sambit Das; William Dawson; Pietro Delugas; Mehmet Dogan et al.
Source: Self-asserted source
Robert Schade

Computing and Compressing Electron Repulsion Integrals on FPGAs

2023 IEEE 31st Annual International Symposium on Field-Programmable Custom Computing Machines (FCCM)
2023-05 | Conference paper
DOI: 10.1109/fccm57271.2023.00026
Contributors: Xin Wu; Tobias Kenter; Robert Schade; Thomas D. Kühne; Christian Plessl
Source: Self-asserted source
Robert Schade

Breaking the exascale barrier for the electronic structure problem in <i>ab-initio</i> molecular dynamics

The International Journal of High Performance Computing Applications
2023-05-29 | Journal article | Author
DOI: 10.1177/10943420231177631
Part of ISSN: 1094-3420
Part of ISSN: 1741-2846
Contributors: Robert Schade; Tobias Kenter; Hossam Elgabarty; Michael Lass; Thomas Kühne; Christian Plessl
Source: Self-asserted source
Robert Schade

CP2K on the road to exascale

2022 | Preprint
DOI: 10.48550/ARXIV.2205.14741
Contributors: Thomas D. Kühne; Christian Plessl; Robert Schade; Ole Schütt
Source: Self-asserted source
Robert Schade

Roadmap on Electronic Structure Codes in the Exascale Era

2022 | Preprint
DOI: 10.48550/ARXIV.2209.12747
Contributors: Vikram Gavini; Stefano Baroni; Volker Blum; David R. Bowler; Alexander Buccheri; James R. Chelikowsky; Sambit Das; William Dawson; Pietro Delugas; Mehmet Dogan et al.
Source: Self-asserted source
Robert Schade

Parallel quantum chemistry on noisy intermediate-scale quantum computers

Physical Review Research
2022-08-29 | Journal article | Author
DOI: 10.1103/physrevresearch.4.033160
Part of ISSN: 2643-1564
Contributors: Robert Schade; Carsten Bauer; Konstantin Tamoev; Lukas Mazur; Christian Plessl; Thomas D. Kühne
Source: Self-asserted source
Robert Schade

Towards electronic structure-based ab-initio molecular dynamics simulations with hundreds of millions of atoms

Parallel Computing
2022-07 | Journal article | Author
DOI: 10.1016/j.parco.2022.102920
Part of ISSN: 0167-8191
Contributors: Robert Schade; Tobias Kenter; Hossam Elgabarty; Michael Lass; Ole Schütt; Alfio Lazzaro; Hans Pabst; Stephan Mohr; Jürg Hutter; Thomas Kühne et al.
Source: Self-asserted source
Robert Schade

CP2K: An electronic structure and molecular dynamics software package - Quickstep: Efficient and accurate electronic structure calculations

The Journal of Chemical Physics
2020-05-21 | Journal article
DOI: 10.1063/5.0007045
Part of ISSN: 0021-9606
Part of ISSN: 1089-7690
Source: Self-asserted source
Robert Schade
grade
Preferred source (of 2)‎

New methods for the ab-initio simulation of correlated systems

2019-03-12 | Dissertation or Thesis
HANDLE: 11858/00-1735-0000-002E-E5C2-7
Source: Self-asserted source
Robert Schade

Adaptive cluster approximation for reduced density-matrix functional theory

Physical Review B
2018-06 | Journal article
DOI: 10.1103/physrevb.97.245131
Part of ISSN: 2469-9950
Contributors: Robert Schade; Peter E. Blöchl
Source: Self-asserted source
Robert Schade via Crossref Metadata Search

Reduced density-matrix functionals from many-particle theory

The European Physical Journal Special Topics
2017-07 | Journal article
DOI: 10.1140/epjst/e2017-70046-0
Part of ISSN: 1951-6355
Contributors: Robert Schade; Ebad Kamil; Peter Blöchl
Source: Self-asserted source
Robert Schade via Crossref Metadata Search

Reduced density-matrix functionals applied to the Hubbard dimer

Physical Review B
2016-02 | Journal article
DOI: 10.1103/physrevb.93.085141
Contributors: Ebad Kamil; Robert Schade; Thomas Pruschke; Peter E. Blöchl
Source: Self-asserted source
Robert Schade via Crossref Metadata Search
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