18 Publications

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[18]
2024 | Journal Article | LibreCat-ID: 53474
Characterizing Microheterogeneity in Liquid Mixtures via Local Density Fluctuations
M. Lass, T. Kenter, C. Plessl, M. Brehm, Entropy 26 (2024).
LibreCat | DOI
 
[17]
2024 | Preprint | LibreCat-ID: 53202
Scalable quantum detector tomography by high-performance computing
T. Schapeler, R. Schade, M. Lass, C. Plessl, T. Bartley, ArXiv:2404.02844 (2024).
LibreCat | arXiv
 
[16]
2024 | Journal Article | LibreCat-ID: 53663 | OA
Noctua 2 Supercomputer
C. Bauer, T. Kenter, M. Lass, L. Mazur, M. Meyer, H. Nitsche, H. Riebler, R. Schade, M. Schwarz, N. Winnwa, A. Wiens, X. Wu, C. Plessl, J. Simon, Journal of Large-Scale Research Facilities 9 (2024).
LibreCat | Files available | DOI
 
[15]
2023 | Journal Article | LibreCat-ID: 45361 | OA
Breaking the exascale barrier for the electronic structure problem in ab-initio molecular dynamics
R. Schade, T. Kenter, H. Elgabarty, M. Lass, T. Kühne, C. Plessl, The International Journal of High Performance Computing Applications (2023).
LibreCat | DOI | Download (ext.)
 
[14]
2023 | Preprint | LibreCat-ID: 43439
A computation of D(9) using FPGA Supercomputing
L. Van Hirtum, P. De Causmaecker, J. Goemaere, T. Kenter, H. Riebler, M. Lass, C. Plessl, ArXiv:2304.03039 (2023).
LibreCat | arXiv
 
[13]
2022 | Dissertation | LibreCat-ID: 32414
Bringing Massive Parallelism and Hardware Acceleration to Linear Scaling Density Functional Theory Through Targeted Approximations
M. Lass, Bringing Massive Parallelism and Hardware Acceleration to Linear Scaling Density Functional Theory Through Targeted Approximations, Universität Paderborn, Paderborn, 2022.
LibreCat | DOI
 
[12]
2022 | Journal Article | LibreCat-ID: 33684 | OA
Towards electronic structure-based ab-initio molecular dynamics simulations with hundreds of millions of atoms
R. Schade, T. Kenter, H. Elgabarty, M. Lass, O. Schütt, A. Lazzaro, H. Pabst, S. Mohr, J. Hutter, T. Kühne, C. Plessl, Parallel Computing 111 (2022).
LibreCat | DOI | Download (ext.)
 
[11]
2020 | Journal Article | LibreCat-ID: 16277 | OA
CP2K: An electronic structure and molecular dynamics software package - Quickstep: Efficient and accurate electronic structure calculations
T. Kühne, M. Iannuzzi, M.D. Ben, V.V. Rybkin, P. Seewald, F. Stein, T. Laino, R.Z. Khaliullin, O. Schütt, F. Schiffmann, D. Golze, J. Wilhelm, S. Chulkov, M.H.B.-H. Mohammad Hossein Bani-Hashemian, V. Weber, U. Borstnik, M. Taillefumier, A.S. Jakobovits, A. Lazzaro, H. Pabst, T. Müller, R. Schade, M. Guidon, S. Andermatt, N. Holmberg, G.K. Schenter, A. Hehn, A. Bussy, F. Belleflamme, G. Tabacchi, A. Glöß, M. Lass, I. Bethune, C.J. Mundy, C. Plessl, M. Watkins, J. VandeVondele, M. Krack, J. Hutter, The Journal of Chemical Physics 152 (2020).
LibreCat | Files available | DOI | Download (ext.) | arXiv
 
[10]
2020 | Conference Paper | LibreCat-ID: 16898
A Submatrix-Based Method for Approximate Matrix Function Evaluation in the Quantum Chemistry Code CP2K
M. Lass, R. Schade, T. Kühne, C. Plessl, in: Proc. International Conference for High Performance Computing, Networking, Storage and Analysis (SC), IEEE Computer Society, Los Alamitos, CA, USA, 2020, pp. 1127–1140.
LibreCat | DOI | Download (ext.) | arXiv
 
[9]
2020 | Journal Article | LibreCat-ID: 12878 | OA
Accurate Sampling with Noisy Forces from Approximate Computing
V. Rengaraj, M. Lass, C. Plessl, T. Kühne, Computation 8 (2020).
LibreCat | DOI | Download (ext.) | arXiv
 
[8]
2019 | Journal Article | LibreCat-ID: 21
A General Algorithm to Calculate the Inverse Principal p-th Root of Symmetric Positive Definite Matrices
D. Richters, M. Lass, A. Walther, C. Plessl, T. Kühne, Communications in Computational Physics 25 (2019) 564–585.
LibreCat | DOI | arXiv
 
[7]
2018 | Journal Article | LibreCat-ID: 20
Using Approximate Computing for the Calculation of Inverse Matrix p-th Roots
M. Lass, T. Kühne, C. Plessl, Embedded Systems Letters 10 (2018) 33–36.
LibreCat | DOI | arXiv
 
[6]
2018 | Conference Paper | LibreCat-ID: 1590
A Massively Parallel Algorithm for the Approximate Calculation of Inverse p-th Roots of Large Sparse Matrices
M. Lass, S. Mohr, H. Wiebeler, T. Kühne, C. Plessl, in: Proc. Platform for Advanced Scientific Computing (PASC) Conference, ACM, New York, NY, USA, 2018.
LibreCat | DOI | arXiv
 
[5]
2017 | Journal Article | LibreCat-ID: 18
Efficient Branch and Bound on FPGAs Using Work Stealing and Instance-Specific Designs
H. Riebler, M. Lass, R. Mittendorf, T. Löcke, C. Plessl, ACM Transactions on Reconfigurable Technology and Systems (TRETS) 10 (2017) 24:1-24:23.
LibreCat | Files available | DOI
 
[4]
2016 | Conference Paper | LibreCat-ID: 19
Confidentiality and Authenticity for Distributed Version Control Systems - A Mercurial Extension
M. Lass, D. Leibenger, C. Sorge, in: Proc. 41st Conference on Local Computer Networks (LCN), IEEE, 2016.
LibreCat | DOI
 
[3]
2016 | Conference Paper | LibreCat-ID: 25
Using Approximate Computing in Scientific Codes
M. Lass, T. Kühne, C. Plessl, in: Workshop on Approximate Computing (AC), 2016.
LibreCat
 
[2]
2015 | Mastersthesis | LibreCat-ID: 1794
Localization and Analysis of Code Paths Suitable for Acceleration using Approximate Computing
M. Lass, Localization and Analysis of Code Paths Suitable for Acceleration Using Approximate Computing, Paderborn University, Paderborn, 2015.
LibreCat
 
[1]
2013 | Bachelorsthesis | LibreCat-ID: 1795
Sichere Speicherung vertraulicher Daten in verteilten Versionskontrollsystemen
M. Lass, Sichere Speicherung Vertraulicher Daten in Verteilten Versionskontrollsystemen, Paderborn University, Paderborn, 2013.
LibreCat
 

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18 Publications

Mark all

[18]
2024 | Journal Article | LibreCat-ID: 53474
Characterizing Microheterogeneity in Liquid Mixtures via Local Density Fluctuations
M. Lass, T. Kenter, C. Plessl, M. Brehm, Entropy 26 (2024).
LibreCat | DOI
 
[17]
2024 | Preprint | LibreCat-ID: 53202
Scalable quantum detector tomography by high-performance computing
T. Schapeler, R. Schade, M. Lass, C. Plessl, T. Bartley, ArXiv:2404.02844 (2024).
LibreCat | arXiv
 
[16]
2024 | Journal Article | LibreCat-ID: 53663 | OA
Noctua 2 Supercomputer
C. Bauer, T. Kenter, M. Lass, L. Mazur, M. Meyer, H. Nitsche, H. Riebler, R. Schade, M. Schwarz, N. Winnwa, A. Wiens, X. Wu, C. Plessl, J. Simon, Journal of Large-Scale Research Facilities 9 (2024).
LibreCat | Files available | DOI
 
[15]
2023 | Journal Article | LibreCat-ID: 45361 | OA
Breaking the exascale barrier for the electronic structure problem in ab-initio molecular dynamics
R. Schade, T. Kenter, H. Elgabarty, M. Lass, T. Kühne, C. Plessl, The International Journal of High Performance Computing Applications (2023).
LibreCat | DOI | Download (ext.)
 
[14]
2023 | Preprint | LibreCat-ID: 43439
A computation of D(9) using FPGA Supercomputing
L. Van Hirtum, P. De Causmaecker, J. Goemaere, T. Kenter, H. Riebler, M. Lass, C. Plessl, ArXiv:2304.03039 (2023).
LibreCat | arXiv
 
[13]
2022 | Dissertation | LibreCat-ID: 32414
Bringing Massive Parallelism and Hardware Acceleration to Linear Scaling Density Functional Theory Through Targeted Approximations
M. Lass, Bringing Massive Parallelism and Hardware Acceleration to Linear Scaling Density Functional Theory Through Targeted Approximations, Universität Paderborn, Paderborn, 2022.
LibreCat | DOI
 
[12]
2022 | Journal Article | LibreCat-ID: 33684 | OA
Towards electronic structure-based ab-initio molecular dynamics simulations with hundreds of millions of atoms
R. Schade, T. Kenter, H. Elgabarty, M. Lass, O. Schütt, A. Lazzaro, H. Pabst, S. Mohr, J. Hutter, T. Kühne, C. Plessl, Parallel Computing 111 (2022).
LibreCat | DOI | Download (ext.)
 
[11]
2020 | Journal Article | LibreCat-ID: 16277 | OA
CP2K: An electronic structure and molecular dynamics software package - Quickstep: Efficient and accurate electronic structure calculations
T. Kühne, M. Iannuzzi, M.D. Ben, V.V. Rybkin, P. Seewald, F. Stein, T. Laino, R.Z. Khaliullin, O. Schütt, F. Schiffmann, D. Golze, J. Wilhelm, S. Chulkov, M.H.B.-H. Mohammad Hossein Bani-Hashemian, V. Weber, U. Borstnik, M. Taillefumier, A.S. Jakobovits, A. Lazzaro, H. Pabst, T. Müller, R. Schade, M. Guidon, S. Andermatt, N. Holmberg, G.K. Schenter, A. Hehn, A. Bussy, F. Belleflamme, G. Tabacchi, A. Glöß, M. Lass, I. Bethune, C.J. Mundy, C. Plessl, M. Watkins, J. VandeVondele, M. Krack, J. Hutter, The Journal of Chemical Physics 152 (2020).
LibreCat | Files available | DOI | Download (ext.) | arXiv
 
[10]
2020 | Conference Paper | LibreCat-ID: 16898
A Submatrix-Based Method for Approximate Matrix Function Evaluation in the Quantum Chemistry Code CP2K
M. Lass, R. Schade, T. Kühne, C. Plessl, in: Proc. International Conference for High Performance Computing, Networking, Storage and Analysis (SC), IEEE Computer Society, Los Alamitos, CA, USA, 2020, pp. 1127–1140.
LibreCat | DOI | Download (ext.) | arXiv
 
[9]
2020 | Journal Article | LibreCat-ID: 12878 | OA
Accurate Sampling with Noisy Forces from Approximate Computing
V. Rengaraj, M. Lass, C. Plessl, T. Kühne, Computation 8 (2020).
LibreCat | DOI | Download (ext.) | arXiv
 
[8]
2019 | Journal Article | LibreCat-ID: 21
A General Algorithm to Calculate the Inverse Principal p-th Root of Symmetric Positive Definite Matrices
D. Richters, M. Lass, A. Walther, C. Plessl, T. Kühne, Communications in Computational Physics 25 (2019) 564–585.
LibreCat | DOI | arXiv
 
[7]
2018 | Journal Article | LibreCat-ID: 20
Using Approximate Computing for the Calculation of Inverse Matrix p-th Roots
M. Lass, T. Kühne, C. Plessl, Embedded Systems Letters 10 (2018) 33–36.
LibreCat | DOI | arXiv
 
[6]
2018 | Conference Paper | LibreCat-ID: 1590
A Massively Parallel Algorithm for the Approximate Calculation of Inverse p-th Roots of Large Sparse Matrices
M. Lass, S. Mohr, H. Wiebeler, T. Kühne, C. Plessl, in: Proc. Platform for Advanced Scientific Computing (PASC) Conference, ACM, New York, NY, USA, 2018.
LibreCat | DOI | arXiv
 
[5]
2017 | Journal Article | LibreCat-ID: 18
Efficient Branch and Bound on FPGAs Using Work Stealing and Instance-Specific Designs
H. Riebler, M. Lass, R. Mittendorf, T. Löcke, C. Plessl, ACM Transactions on Reconfigurable Technology and Systems (TRETS) 10 (2017) 24:1-24:23.
LibreCat | Files available | DOI
 
[4]
2016 | Conference Paper | LibreCat-ID: 19
Confidentiality and Authenticity for Distributed Version Control Systems - A Mercurial Extension
M. Lass, D. Leibenger, C. Sorge, in: Proc. 41st Conference on Local Computer Networks (LCN), IEEE, 2016.
LibreCat | DOI
 
[3]
2016 | Conference Paper | LibreCat-ID: 25
Using Approximate Computing in Scientific Codes
M. Lass, T. Kühne, C. Plessl, in: Workshop on Approximate Computing (AC), 2016.
LibreCat
 
[2]
2015 | Mastersthesis | LibreCat-ID: 1794
Localization and Analysis of Code Paths Suitable for Acceleration using Approximate Computing
M. Lass, Localization and Analysis of Code Paths Suitable for Acceleration Using Approximate Computing, Paderborn University, Paderborn, 2015.
LibreCat
 
[1]
2013 | Bachelorsthesis | LibreCat-ID: 1795
Sichere Speicherung vertraulicher Daten in verteilten Versionskontrollsystemen
M. Lass, Sichere Speicherung Vertraulicher Daten in Verteilten Versionskontrollsystemen, Paderborn University, Paderborn, 2013.
LibreCat
 

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