JuLib | Articles & more - {"Quantum Materials"}

1

ChASE-library/ChASE: ChASE v1.3.0. Major release.

WU, Xinzhe
2023

“...Simulation and Data Laboratory Quantum Materials (SDLQM)...”

2

Computing formation enthalpies through an explainable machine learning method: the case of Lanthanide Orthophosphates solid solutions

Di Napoli, Edoardo
2023

“...Simulation and Data Laboratory Quantum Materials (SDLQM)...”
OpenAccess

3

Software

ChASE-library/ChASE: ChASE (v1.4.0)

Wu, Xinzhe
2023

“...Simulation and Data Laboratory Quantum Materials (SDLQM)...”

4

Conference Presentation

Advancing the Distributed Multi-GPU ChASE Library through Algorithm Optimization and NCCL Library

Di Napoli, Edoardo
2023

“...Simulation and Data Laboratory Quantum Materials (SDLQM)...”

5

Contribution to a conference proceedings

Advancing the distributed Multi-GPU ChASE library through algorithm optimization and NCCL library

Wu, Xinzhe
2023

“...Simulation and Data Laboratory Quantum Materials (SDLQM)...”
Get full text OpenAccess

6

Poster

CASA Simulation and Data Lab Quantum Materials

Di Napoli, Edoardo
2023

“...Simulation and Data Laboratory Quantum Materials (SDLQM)...”

7

Talk (non-conference)

The evolution of chase towards JUWELS Booster execution at scale

Di Napoli, Edoardo
2023

“...Simulation and Data Laboratory Quantum Materials (SDLQM)...”

8

Contribution to a book
Contribution to a conference proceedings

ChASE - A Distributed Hybrid CPU-GPU Eigensolver for Large-scale Hermitian Eigenvalue Problems

Wu, Xinzhe
2022

S. Article No.: 9

“...Simulation and Data Laboratory Quantum Materials (SDLQM)...”
OpenAccess

9

Software

ChASE-library/ChASE: ChASE v1.1.2 Release

Winkelmann, Jan
2022

“...Simulation and Data Laboratory Quantum Materials (SDLQM)...”

10

Conference Presentation

ChASE - A Distributed Hybrid CPU-GPU Eigensolver for Large-scale Hermitian Eigenvalue Problems

Wu, Xinzhe
2022

“...Simulation and Data Laboratory Quantum Materials (SDLQM)...”
OpenAccess

11

Journal Article

Editorial: High-performance tensor computations in scientific computing and data science

Di Napoli, Edoardo
2022

Frontiers in applied mathematics and statistics, 8 (2022) S. 1038885

“...Simulation and Data Laboratory Quantum Materials (SDLQM)...”
OpenAccess

12

Conference Presentation

ChAS(E)ing Hermitian dense eigenproblems with subspace iteration on large scale hybrid platforms with application to DFT

Di Napoli, Edoardo
2022

“...Simulation and Data Laboratory Quantum Materials (SDLQM)...”
OpenAccess

13

Journal Article

Solution to the modified Helmholtz equation for arbitrary periodic charge densities

Winkelmann, Miriam
2021

Frontiers in physics, 8 (2021) S. 618142

“...Simulation and Data Laboratory Quantum Materials (SDLQM)...”
OpenAccess

14

Conference Presentation

Kerker mixing scheme for self-consistent muffin-tin based all-electron electronic structure calculations

Winkelmann, Miriam
2021

“...Simulation and Data Laboratory Quantum Materials (SDLQM)...”

15

Journal Article

Solving the Bethe-Salpeter equation on massively parallel architectures

Zhang, Xiao
2021

Computer physics communications, 267 (2021) S. 108081

“...Simulation and Data Laboratory Quantum Materials (SDLQM)...”
OpenAccess

16

Journal Article

Rational Spectral Filters with Optimal Convergence Rate

Kollnig, Konrad
2021

SIAM journal on scientific computing, 43 (2021) 4, S. A2660–A2684

“...Simulation and Data Laboratory Quantum Materials (SDLQM)...”
OpenAccess

17

Contribution to a book
Contribution to a conference proceedings

Developing Exascale Computing at JSC

Suarez, Estela
2020

“...Simulation and Data Laboratory Quantum Materials (SDLQM)...”
OpenAccess OpenAccess

18

Journal Article

The LAPW Method with Eigendecomposition Based on the Hari--Zimmermann Generalized Hyperbolic SVD

Singer, Sanja
2020

SIAM journal on scientific computing, 42 (2020) 5, S. C265–C293

“...Simulation and Data Laboratory Quantum Materials (SDLQM)...”
OpenAccess OpenAccess

19

Journal Article

A Modified Ising Model of Barabási-Albert Network with Gene-type Spins

Krishnan, Jeyashree
2020

Journal of mathematical biology, 81 (2020) S. 769–798

“...Simulation and Data Laboratory Quantum Materials (SDLQM)...”
OpenAccess OpenAccess

20

Journal Article

Kerker mixing scheme for self-consistent muffin-tin based all-electron electronic structure calculations

Winkelmann, Miriam
2020

Physical Review B Physical review / B, 102 102 (2020 2020) 19 19, S. 195138 195138

“...Simulation and Data Laboratory Quantum Materials (SDLQM)...”
OpenAccess

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