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Search for publications relevant for "first-principles simulation"
first-principles simulation
Publication
Class
Person
Publication
Programmes
publication
Optimization of quasi-hemispherical CdZnTe detectors by means of first principles simulation
2023 |
Faculty of Mathematics and Physics
publication
CO2 thermoreduction to methanol on the MoS2 supported single Co atom catalyst: A DFT study
2020 |
Faculty of Science
publication
Submolecular Resolution by Variation of the Inelastic Electron Tunneling Spectroscopy Amplitude and its Relation to the AFM/STM Signal
2017 |
Faculty of Mathematics and Physics
publication
Experimental Observations versus First-Principles Calculations for Ni-Mn-Ga Ferromagnetic Shape Memory Alloys: A Review
2022 |
Faculty of Mathematics and Physics
publication
Study of Rechargeable Batteries Using Advanced Spectroscopic and Computational Techniques
2021 |
Faculty of Mathematics and Physics
publication
Quantum coherent interactions between electron vortices and chiral optical near fields
2023 |
Faculty of Mathematics and Physics
publication
Synthesis of single layer graphene on Cu(111) by C-60 supersonic molecular beam epitaxy
2016 |
Faculty of Mathematics and Physics
publication
On the interaction of Mg with the (111) and (110) surfaces of ceria
2012 |
Faculty of Mathematics and Physics