Lenz Fiedler - Publications, H-index & Citations

Lenz Fiedler

technical university freiberg

6H指数

21论文数

306被引数

收录论文 8

发表时间

Materials Learning Algorithms (MALA): Scalable machine learning for electronic structure calculations in large-scale atomistic simulations Materials Learning Algorithms (MALA): 可扩展机器学习方法，用于大规模原子模拟中的电子结构计算

COMPUTER PHYSICS COMMUNICATIONS

IF3.4

2025-06-06

OAAI

Cangi, Attila; Fiedler, Lenz; Brzoza, Bartosz; Shah, Karan; Callow, Timothy J.; Kotik, Daniel; Schmerler, Steve; Barry, Matthew C.; Goff, James M.; Rohskopf, Andrew; Vogel, Dayton J.; Modine, Normand; Thompson, Aidan P.; Rajamanickam, Sivasankaran

Predicting electronic structures at any length scale with machine learning

NPJ COMPUTATIONAL MATERIALS

IF11.9

2023-06-27

OAAI

Fiedler, Lenz; Modine, Normand A. A.; Schmerler, Steve; Vogel, Dayton J. J.; Popoola, Gabriel A. A.; Thompson, Aidan P. P.; Rajamanickam, Sivasankaran; Cangi, Attila

Training-free hyperparameter optimization of neural networks for electronic structures in matter 用于物质中电子结构的神经网络的无训练超参数优化

MACHINE LEARNING-SCIENCE AND TECHNOLOGY

IF4.6

2022-10-28

OAAI

Fiedler, Lenz; Hoffmann, Nils; Mohammed, Parvez; Popoola, Gabriel A.; Yovell, Tamar; Oles, Vladyslav; Ellis, J. Austin; Rajamanickam, Sivasankaran; Cangi, Attila

Accelerating equilibration in first-principles molecular dynamics with orbital-free density functional theory

PHYSICAL REVIEW RESEARCH

IF4.2

2022-10-17

OAAI

Fiedler, Lenz; Moldabekov, Zhandos A.; Shao, Xuecheng; Jiang, Kaili; Dornheim, Tobias; Pavanello, Michele; Cangi, Attila

Deep dive into machine learning density functional theory for materials science and chemistry

PHYSICAL REVIEW MATERIALS

IF3.4

2022-04-05

OAAI

Fiedler, L.; Shah, K.; Bussmann, M.; Cangi, A.