Forschungsgruppe Computational Materials Science - Home of WIEN2k

Organization Name (de) Name der Organisation (de)
E165-03-2 - Forschungsgruppe Computational Materials Science - Home of WIEN2k
 
Code Kennzahl
E165-03-2
 
Type of Organization Organisationstyp
Research Group
 
Parent OrgUnit Übergeordnete Organisation
Active Aktiv
 


Results 1-20 of 30 (Search time: 0.002 seconds).

PreviewAuthors / EditorsTitleTypeIssue Date
1Bichler, Magdalena ; Kraushofer, Florian ; Zdenek, Jakub ; Parkinson, Gareth S. ; Blaha, Peter The (O12) surfaces of hematite and their interactions with water - a DFT studyPräsentation Presentation2018
2Bichler, Magdalena The (012) surfaces of hematite and their interactions with water - a DFT studyPräsentation Presentation2018
3Bichler, Magdalena ; Kraushofer, Florian ; Jakub, Zdenek ; Parkinson, Gareth S. ; Blaha, Peter The (012) surfaces of hematite and their interactions with water - a DFT studyPräsentation Presentation2017
4Bichler, Magdalena ; Kraushofer, Florian ; Zdenek, Jakub ; Parkinson, Gareth S. ; Blaha, Peter The (012) Surfaces of Hematite - a DFT StudyPräsentation Presentation2017
5Bichler, Magdalena ; Blaha, Peter The (012) Surfaces of Hematite - a DFT StudyPräsentation Presentation2018
6Bichler, Magdalena The (012) Surface of Hematite and their Interactions with WaterPräsentation Presentation2018
7Bichler, Magdalena ; Blaha, Peter The (012) surface of Hematite and their AFM structurePräsentation Presentation2017
8Kraushofer, Florian ; Franceschi, Giada ; Zdenek, Jakub ; Bichler, Magdalena ; Riva, Michele ; Schmid, Michael ; Diebold, Ulrike ; Blaha, Peter ; Parkinson, Gareth S. Surface structure of Ti-doped Hematite α-Fe2O3 films grown by pulsed laser depositionPräsentation Presentation2019
9Bichler, Magdalena ; Blaha, Peter Structure optimization of 2H-MoSe₂ and 1T-MoSe₂Präsentation Presentation2016
10Doumont, Jan ; Tran, F Recent developments in semilocal functionals for solidsPräsentation Presentation2018
11Felgitsch, Laura ; Bichler, Magdalena ; Häusler, Thomas ; Weiss, Victor ; Marchetti-Deschmann, Martina ; Ofner, Johannes ; Allmaier, Günter ; Grothe, Hinrich Molecular Surface Chemistry on Birch PollenPräsentation Presentation2015
12Felgitsch, Laura ; Bichler, Magdalena ; Häusler, Thomas ; Weiss, Victor ; Marchetti-Deschmann, Martina ; Allmaier, Günter ; Grothe, Hinrich Molecular Ice Nucleation Activity of Birch PollenKonferenzbeitrag Inproceedings2015
13Felgitsch, Laura ; Bichler, Magdalena ; Grothe, Hinrich Macromolecular Ice Nuclei of Biological Origin and their Possible Atmospheric RelevanceKonferenzbeitrag Inproceedings2016
14Felgitsch, Laura ; Bichler, Magdalena ; Häusler, Thomas ; Weiss, Victor ; Marchetti-Deschmann, Martina ; Allmaier, Günter ; Grothe, Hinrich Macromolecular ice nucleation activity of birch pollenPräsentation Presentation2015
15Doumont, Jan Limitations of the LDA-1/2Technique for Calculating Band Gaps in DFTPräsentation Presentation2018
16Doumont, Jan ; Tran, F ; Blaha, Peter Limitations of the DFT-1/2 method for covalent semiconductors and transition-metal oxidesPräsentation Presentation2019
17Tröster, Andreas ; Belbase, Kamal ; Blaha, Peter Implementation of Stress Tensor in the LAPW MethodPräsentation Presentation2017
18Belbase, Kamal ; Tröster, Andreas ; Blaha, Peter Implementation of stress tensor in LAPW method with emphasis on WIEN2kPräsentation Presentation2019
19Bichler, Magdalena ; Felgitsch, Laura ; Seidl-Seiboth, Verena ; Grothe, Hinrich Ice Nucleation Triggered by Biological SubstancesKonferenzbeitrag Inproceedings2015
20Bagheri, Mahdiyar ; Blaha, Peter Energy dependence of XPS Valence band spectoscpopy: DFT calculations in comparisson with hard X-ray photo emission experimentsPräsentation Presentation2017