Publikationen von Christian Carbogno
Alle Typen
Zeitschriftenartikel (31)
21.
Zeitschriftenartikel
57 (21), S. 6130 - 6135 (2018)
Local Atomic Arrangements and Band Structure of Boron Carbide. Angewandte Chemie International Edition 22.
Zeitschriftenartikel
130 (21), S. 6238 - 6243 (2018)
Local Atomic Arrangements and Band Structure of Boron Carbide. Angewandte Chemie 23.
Zeitschriftenartikel
3, 46 (2017)
Towards efficient data exchange and sharing for big-data driven materials science: metadata and data formats. npj Computational Materials 24.
Zeitschriftenartikel
118 (23), 236401 (2017)
Formation of Vacancies in Si- and Ge-based Clathrates: Role of Electron Localization and Symmetry Breaking. Physical Review Letters 25.
Zeitschriftenartikel
215, S. 26 - 46 (2017)
Lattice dynamics calculations based on density-functional perturbation theory in real space. Computer Physics Communications 26.
Zeitschriftenartikel
118 (17), 175901 (2017)
Ab Initio Green-Kubo Approach for the Thermal Conductivity of Solids. Physical Review Letters 27.
Zeitschriftenartikel
190, S. 33 - 50 (2015)
All-electron formalism for total energy strain derivatives and stress tensor components for numeric atom-centered orbitals. Computer Physics Communications 28.
Zeitschriftenartikel
6 (4), 6901 (2015)
Evidence for photogenerated intermediate hole polarons in ZnO. Nature Communications 29.
Zeitschriftenartikel
90 (14), 144109 (2014)
Ferroelastic switching of doped zirconia: Modeling and understanding from first principles. Physical Review B 30.
Zeitschriftenartikel
50 (43), S. 10221 - 10225 (2011)
Activation Energies for Diffusion of Defects in Silicon: The Role of the Exchange-Correlation Functional. Angewandte Chemie International Edition 31.
Zeitschriftenartikel
84, 035317 (2011)
Thermal conductivity of Si nanostructures containing defects: Methodology, isotope effects, and phonon trapping. Physical Review B Buchkapitel (4)
32.
Buchkapitel
Preparing electronic-structure theory for the exascale. In: High-Performance Computing and Data Science in the Max Planck Society, S. 47 - 49. Max Planck Computing and Data Facility, Garching (2021)
33.
Buchkapitel
Identifying novel thermal insulators in material space. In: High-Performance Computing and Data Science in the Max Planck Society, S. 42 - 43. Max Planck Computing and Data Facility, Garching (2021)
34.
Buchkapitel
36, S. 647 - 668. IOS Press, Amsterdam (2020)
ELPA: A parallel solver for the generalized eigenvalue problem. In: Parallel Computing: Technology Trends, Bd. 35.
Buchkapitel
O2 Adsorption Dynamics at Metal Surfaces: Non-adiabatic Effects, Dissociation and Dissipation. In: Dynamics of Gas-Surface Interactions: Atomic-level Understanding of Scattering Processes at Surfaces, S. 389 - 419 (Hg. Díez Muiño, R.; Busnengo, H. F.). Springer, Berlin, Heidelberg (2013)
Konferenzbeitrag (1)
36.
Konferenzbeitrag
Momentum-resolved non-radiative energy flow in photoexcited black phosphorus. In: Optics Infobase Conference Papers. The International Conference on Ultrafast Phenomena (UP) 2022, Montreal, 18. Juli 2022 - 22. Juli 2022. (2022)
Vortrag (83)
37.
Vortrag
Anharmonic Effects in Heat and Charge Transport: Fundamental Concepts, Novel Methods, and Relevant Applications. Seminar Physical and Theoretical Chemistry, Institute of Chemistry, University of Graz, Graz, Austia (2023)
38.
Vortrag
Electronic Transport. FHI-aims Developers' and Users' Meeting 2023, Electronic Structure Theory with Numeric Atom-Centered Basis Functions, Hamburg, Germany (2023)
39.
Vortrag
Anharmonic Effects in Heat and Charge Transport: Fundamental Concepts, Novel Methods, And Relevant Applications. Seminar, Warwick Centre for Predictive Modelling, University of Warwick, Coventry, UK (2023)
40.
Vortrag
Heat and Charge Transport: Past, Present, and Future Developments. NOMAD Meeting, Revealing New and Novel Materials, Mechanisms, and Insights (a Perspective), Potsdam, Germany (2022)