420 citations · 4k across the 52 of their papers we have counts for
52 papers
ESPResSo++: A Fast and Extensible Molecular Simulation Package for Coarse-Grained Models
Zhen-Hao Xu, James Vance, Nikita Tretyakov +9
ESPResSo++ is an open-source software package for molecular dynamics (MD) simulations with a particular emphasis on coarse-grained (CG) models of soft matter systems. Written in C+…
FROST-CLUSTERS -- III. Metallicity-dependent intermediate mass black hole formation by runaway collisions in dense star clusters
Antti Rantala, Thorsten Naab, Natalia Lahén +4
We explore the formation of intermediate mass black holes (IMBHs), potential seeds for supermassive black holes (SMBHs), via runaway stellar collisions for a wide range of star clu…
Roadmap on Advancements of the FHI-aims Software Package
Joseph W. Abbott, Carlos Mera Acosta, Alaa Akkoush +203
Electronic-structure theory is the foundation of the description of materials including multiscale modeling of their properties and functions. Obviously, without sufficient accurac…
A high-performance and portable implementation of the SISSO method for CPUs and GPUs
Sebastian Eibl, Yi Yao, Matthias Scheffler +3
SISSO (sure-independence screening and sparsifying operator) is an artificial intelligence (AI) method based on symbolic regression and compressed sensing widely used in materials…
FORTE: An Open-Source System for Cost-Effective and Scalable Environmental Monitoring
Zoe Pfister, Michael Vierhauser, Alzbeta Medvedova +8
Forests are an essential part of our biosphere, regulating climate, acting as a sink for greenhouse gases, and providing numerous other ecosystem services. However, they are negati…
A Study of Performance Portability in Plasma Physics Simulations
Josef Ruzicka, Christian Asch, Esteban Meneses +2
The high-performance computing (HPC) community has recently seen a substantial diversification of hardware platforms and their associated programming models. From traditional multi…