Publications of Matthias Scheffler
All genres
Talk (193)
841.
Talk
Reliability and robustness of density-functional theory and GW calculations. APS March Meeting, Boston, USA (2012)
842.
Talk
Role of van der Waals interactions in adsorption and at inorganic/organic interfaces. Symposium on Surface and Nano Science 2012, Shizukuishi, Japan (2012)
843.
Talk
Role of van der Waals interactions in physics, chemistry, and biology. Materials Research Outreach Symposium, UCSB, Santa Barbara, USA (2012)
844.
Talk
The base of multi-scale modeling: Assessing the accuracy and reliability of electronic-structure theory. CECAM-Workshop on Perspectives and Challenges of Many-Particle Methods, Bremen, Germany (2011)
Thesis - PhD (37)
845.
Thesis - PhD
Machine Learning for Atomistic Modeling: Representations and Thermal Transport. Dissertation, Technische Universität, Berlin (2023)
846.
Thesis - PhD
Self-interaction corrected SCAN functional for molecules and solids in the numeric atom-center orbital framework. Dissertation, Humboldt Universität zu, Berlin (2023)
847.
Thesis - PhD
Quasiparticle energies from second-order perturbation theory. Dissertation, Freie Universität, Berlin (2022)
848.
Thesis - PhD
Systematic identification of relevant features for the statistical modeling of materials properties of crystalline solids. Dissertation, Freie Universität, Berlin (2022)
849.
Thesis - PhD
Robust recognition and exploratory analysis of crystal structures using machine learning. Dissertation, Humboldt Universität, Berlin (2022)
850.
Thesis - PhD
Artificial intelligence for crystal structure prediction. Dissertation, Technische Universität, Berlin (2022)
851.
Thesis - PhD
Heat transport in strongly anharmonic solids from first principles. Dissertation, Humboldt-Universität zu, Berlin (2022)
852.
Thesis - PhD
Electrical conductivity from first principles. Dissertation, Humboldt-Universität zu, Berlin (2022)
853.
Thesis - PhD
Towards efficient novel materials discovery: Acceleration of high-throughput calculations and semantic management of big data using ontologies. Dissertation, Humboldt-Universität, Berlin (2022)
854.
Thesis - PhD
Surface Phase Diagrams Including Anharmonic Effects via a Replica-Exchange Grand-Canonical Method. Dissertation, Technische Universität, Berlin (2020)
855.
Thesis - PhD
First-principles Investigation of Small Polarons in Metal Oxides. Dissertation, Humboldt Universität, Berlin (2018)
856.
Thesis - PhD
Lower-scaling advanced correlation methods with local Resolution of Identity strategies: A large-scale parallel and in-memory Laplace-Transformed MP2 for both molecular and periodic systems. Dissertation, Freie Universität, Berlin (2017)
857.
Thesis - PhD
Exploring Molecular Conformational Space. Dissertation, Freie Universität, Berlin (2016)
858.
Thesis - PhD
Adsorbate-adsorbate interactions on metal and metal oxide surfaces: critical role in surface structures and reactions. Dissertation, Technische Universität, Berlin (2015)
859.
Thesis - PhD
Strain and Stress: Derivation, Implementation, and Application to Organic Crystals. Dissertation, Freie Universität, Berlin (2015)
860.
Thesis - PhD
Charged point defects in oxides – a case study of MgO bulk and surface F centers. Dissertation, Technische Universität, Berlin (2013)