Sahu, R.: Study of phase impurity, 2D and 3D defects in orthorhombic MoAlB MAB phase. Advances in Correlative Microscopy Workshop, IIT Madras, Chennai, India (2020)
Sahu, R.; Singh Negi, D.; Scheu, C.: Local strain field in distorted 1T (1Td) MoS2 phases by GPA. International Workshop on Advanced and In-situ Microscopies of Functional Nanomaterials and Devices, IAMNano 2019, Düsseldorf, Germany (2019)
Sahu, R.; Völker, B.; Stelzer , B.; Chen, X.; Bliem , P.; Hans, M.; Primetzhofer, D.; Schneider, J. M.; Scheu, C.: Phase transitions in Cr2AlC thin films by in situ TEM heating experiment. Fifth Conference on Frontiers of Aberration Corrected Electron Microscopy, PICO 2019, Vaalsbroek, The Netherlands (2019)
Max Planck scientists design a process that merges metal extraction, alloying and processing into one single, eco-friendly step. Their results are now published in the journal Nature.
It is very challenging to simulate electron-transfer reactions under potential control within high-level electronic structure theory, e. g. to study electrochemical and electrocatalytic reaction mechanisms. We develop a novel method to sample the canonical NVTΦ or NpTΦ ensemble at constant electrode potential in ab initio molecular dynamics…