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Kaveh Haghighi Mood
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DFT/B3LYP study of the substituent effect on the reaction enthalpies of the individual steps of single electron transfer–proton transfer and sequential proton loss electron …
M Najafi, KH Mood, M Zahedi, E Klein
Computational and Theoretical Chemistry 969 (1-3), 1-12, 2011
392011
DFT/B3LYP study of the substituent effects on OH bond dissociation enthalpies of chroman derivatives in the gas phase and solvent environment
M Najafi, E Nazarparvar, KH Mood, M Zahedi, E Klein
Computational and Theoretical Chemistry 965 (1), 114-122, 2011
332011
Massive-Parallel Trajectory Calculations version 2.2 (MPTRAC-2.2): Lagrangian transport simulations on graphics processing units (GPUs)
L Hoffmann, PF Baumeister, Z Cai, J Clemens, S Grießbach, G Günther, ...
Geoscientific Model Development 15 (7), 2731-2762, 2022
28*2022
Generic expansion of the Jastrow correlation factor in polynomials satisfying symmetry and cusp conditions
A Lüchow, A Sturm, C Schulte, K Haghighi Mood
The Journal of Chemical Physics 142 (8), 2015
262015
Full wave function optimization with quantum Monte Carlo and its effect on the dissociation energy of FeS
K Haghighi Mood, A Lüchow
The Journal of Physical Chemistry A 121 (32), 6165-6171, 2017
192017
Massive-Parallel Trajectory Calculations (MPTRAC)
L Hoffmann, J Clemens, M Liu, K Haghighi Mood, Y Lu
Zenodo [code] 10, 2018
15*2018
A modular workflow for performance benchmarking of neuronal network simulations
J Albers, J Pronold, AC Kurth, SB Vennemo, K Haghighi Mood, A Patronis, ...
Frontiers in neuroinformatics 16, 837549, 2022
142022
Full Wave Function Optimization with Quantum Monte Carlo—A Study of the Dissociation Energies of ZnO, FeO, FeH, and CrS
J Ludovicy, KH Mood, A Lüchow
Journal of chemical theory and computation 15 (10), 5221-5229, 2019
112019
Amolqc
A Lüchow, S Manten, C Diedrich, A Bande, TC Scott, A Schwarz, R Berner, ...
Zenodo, 2021
7*2021
Application-driven exascale: The JUPITER benchmark suite
A Herten, S Achilles, D Alvarez, J Badwaik, E Behle, M Bode, T Breuer, ...
SC24: International Conference for High Performance Computing, Networking …, 2024
42024
Programmatically Reaching the Roof: Automated BLIS Kernel Generator for SVE and RVV
S Nassyr, KH Mood, A Herten
32023
Accelerating Lagrangian transport simulations on graphics processing units: performance optimizations of Massive-Parallel Trajectory Calculations (MPTRAC) v2. 6
L Hoffmann, K Haghighi Mood, A Herten, M Hrywniak, J Kraus, J Clemens, ...
Geoscientific Model Development 17 (9), 4077-4094, 2024
22024
Performance measurements of MPTRAC v2. 2, Zenodo [data set]
K Haghighi Mood, L Hoffmann
22022
Taming the Beasts: A Practical Overview of GPU Programming Models
A Herten, J Badwaik, K Haghighi Mood
3rd natESM Training Workshop, 2024
2024
GPU Programming Part 2: Advanced GPU Programming
J Meinke, M Hrywniak, K Haghighi Mood, A Herten, J Kraus
JSC-as part of the Training Programme of Forschungszentrum Jülich, 2023
2023
Many Ways to GPUs-A GPU Introduction
A Herten, K Haghighi Mood
DKRZ User Workshop-natESM Hands-on Session, 2022
2022
GPU Programming with CUDA
A Herten, J Meinke, K Haghighi Mood, J Kraus, M Hrywniak
PRACE Training Course at JSC, 2022
2022
Directive-based GPU programming with OpenACC
A Herten, T Hater, J Kraus, M Hrywniak, K Haghighi Mood
PRACE Training Course at JSC, 2022
2022
beNNch–Finding Performance Bottlenecks of Neuronal Network Simulators
J Albers, J Senk, J Jordan, A Kurth, SB Vennemo, K Haghighi Mood, ...
NEST Conference, 2022
2022
PRACE Training Course: Directive-based GPU programming with OpenACC
A Herten, T Hater, J Kraus, M Hrywniak, K Haghighi Mood
Jülich Supercomputing Center, 2021
2021
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Artigos 1–20