June 16, 2020
Shoshana Jakobovits
Shoshana Jakobovits received her BSc in Physics from EPFL and her MSc in Computational Science and...
June 16, 2020
Simon Frasch
Simon Frasch received his BSc and MSc in Computational Science and Engineering from ETH Zurich,...
June 16, 2020
Anton Kozhevnikov
Anton Kozhevnikov is a computational scientist and the group lead in the Scientific Software and...
June 16, 2020
Marko Kabic
Finished Master studies in Computer Science at ETH Zurich, where he also worked as a research and...
June 16, 2020
HPC libraries for CP2K and other electronic structure codes
Thank you for joining the M A X webinar on " HPC libraries for CP2K and other electronic structure...
June 15, 2020
Constructing Dual-Molecule Junctions to Probe Intermolecular Crosstalk
X.H. Wu, F. Chen, F. Yan, L.Q. Pei, R. Hou, J.R. Horsley, A.D. Abell, X.S. Zhou, J.X. Yu, D.F. Li,...
June 9, 2020
HPC libraries for CP2K and other electronic structure codes
The Webinar will provide an accurate overview of the HPC libraries developed at CSCS in order to...
June 9, 2020
Rapid Prediction of Bimetallic Mixing Behavior at the Nanoscale
J. Dean, M.J. Cowan, J. Estes, M. Ramadan, and G. Mpourmpakis
June 5, 2020
Introduction to running reproducible workflows with AiiDA
Event: AiiDA School on High-throughput computing Where: digital event Who (in-charge): EPFL What: School When: July 6-9, 2021
June 5, 2020
AiiDA Virtual Tutorial
MaX and the AiiDA team are pleased to announce the detailed program of the AiiDA tutorial week:...
June 5, 2020
Photoelectron spectra of alkali metal–ammonia microjets: From blue electrolyte to bronze metal
Liquid ammonia is unusual in its capacity to host electrons in stable solution, with vivid blue and...
June 5, 2020
Photoelectron spectra of alkali metal-ammonia microjets: From blue electrolyte to bronze metal
T. Buttersack, P.E. Mason, R.S. McMullen, H.C. Schewe, T. Martinek, K. Brezina, M. Crhan, A. Gomez...
June 3, 2020
Plasma-Treated Ultrathin Ternary FePSe3 Nanosheets as a Bifunctional Electrocatalyst for Efficient Zinc-Air Batteries
Y.A. Hao, A.J. Huang, S.L. Han, H.J. Huang, J.N. Song, X.L. Sun, Z.G. Wang, L.L. Li, F. Hu, J.J...
June 1, 2020
Andrea Marini
Andrea Marini is the coordinator of the ab-initio Yambo project, head of the Division of Ultrafast...
June 1, 2020
Ab initio studies of the optoelectronic structure of undoped and doped silicon nanocrystals and nanowires: the role of size, passivation, symmetry and phase
S. Ossicini, I.Marri, M. Amato, M. Palummo, E. Canadell, and R. Rurali
June 1, 2020
Ab initio studies of the optoelectronic structure of undoped and doped silicon nanocrystals and nanowires: the role of size, passivation, symmetry and phase
Silicon nanocrystals and nanowires have been extensively studied because of their novel properties...
June 1, 2020
Biomimetic micro cell cathode for high performance lithium-sulfur batteries
S.Y. Zhou, J.Y. Hu, S.G. Liu, J.X. Lin, J. Cheng, T. Mei, X.B. Wang, H.G. Liao, L. Huang, and S.G...
June 1, 2020
Ultrastable Sodium-Sulfur Batteries without Polysulfides Formation Using Slit Ultramicropore Carbon Carrier
Q.B. Guo, S. Li, X.J. Liu, H.C. Lu, X.Q. Chang, H.S. Zhang, X.H. Zhu, Q.Y. Xia, C.L. Yan, and H. Xia
May 29, 2020
Cross-plane transport in a single-molecule two-dimensional van der Waals heterojunction
Two-dimensional van der Waals heterojunctions (2D-vdWHs) stacked from atomically thick 2D materials...
May 29, 2020
Control of zeolite pore interior for chemoselective alkyne/olefin separations
Y. C. Chai, X. Han, W.Y. Li, S.S. Liu, S.K. Yao, C. Wang, W. Shi, I. Da-Silva, P. Manuel, Y.Q...
May 29, 2020
Computational framework for a systematic investigation of anionic redox process in Li-rich compounds
A.S. Tygesen, J.H. Chang, T. Vegge, and J.M. Garcia-Lastra
May 28, 2020
AiiDA Webinar - Highlights and Takeaways
Last 27th of May, the second webinar of the M A X series on Flagship codes entitled “ Managing,...