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Many-Body Self-Interaction and Polarons

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Crystalline and correlated phases in two-dimensional transition metal dichalcogenides

Diego José Pasquier

This thesis is dedicated to the study of various aspects of the electronic structure of two-dimensional transition metal dichalcogenides (TMDs) of chemical composition MX

_2

(where M is a transition metal atom and X= S, Se, Te), using a combination of \te ...

EPFL2019

Many-Body Self-Interaction and Polarons

Graph Chatbot

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Koopmans-Compliant Functionals and Potentials and Their Application to the GW100 Test Set

Crystalline and correlated phases in two-dimensional transition metal dichalcogenides

Comparison of permutationally invariant polynomials, neural networks, and Gaussian approximation potentials in representing water interactions through many-body expansions

Nonequilibrium Dynamics of Collective Excitations in Strongly Interacting and Correlated Quantum Systems

Localized electronic states at grain boundaries on the surface of graphene and graphite

Density Functional Theory Calculations of Topological Insulators

Koopmans-compliant functionals and their performance against reference molecular data

Minimizing Density Functional Failures for Non-covalent Interactions beyond van der Waals Complexes

Phonon-limited resistivity of graphene by first-principles calculations: Electron-phonon interactions, strain-induced gauge field, and Boltzmann equation

Electron-Phonon Interactions and the Intrinsic Electrical Resistivity of Graphene

Koopmans-Compliant Functionals and Potentials and Their Application to the GW100 Test Set

Minimizing Density Functional Failures for Non-covalent Interactions beyond van der Waals Complexes

Localized electronic states at grain boundaries on the surface of graphene and graphite

Nonequilibrium Dynamics of Collective Excitations in Strongly Interacting and Correlated Quantum Systems

Density Functional Theory Calculations of Topological Insulators

Crystalline and correlated phases in two-dimensional transition metal dichalcogenides

Phonon-limited resistivity of graphene by first-principles calculations: Electron-phonon interactions, strain-induced gauge field, and Boltzmann equation

Electron-Phonon Interactions and the Intrinsic Electrical Resistivity of Graphene

Comparison of permutationally invariant polynomials, neural networks, and Gaussian approximation potentials in representing water interactions through many-body expansions

Koopmans-compliant functionals and their performance against reference molecular data