Andreas Dreuw
Orcid: 0000-0002-5862-5113
According to our database1,
Andreas Dreuw
authored at least 9 papers
between 2011 and 2023.
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Bibliography
2023
KineticNet: Deep learning a transferable kinetic energy functional for orbital-free density functional theory.
CoRR, 2023
2021
Geometry dependence of excitonic couplings and the consequences for configuration-space sampling.
J. Comput. Chem., 2021
Deciphering excited state properties utilizing algebraic diagrammatic construction schemes of decreasing order.
J. Comput. Chem., 2021
2017
Evaluation of the restricted virtual space approximation in the algebraic-diagrammatic construction scheme for the polarization propagator to speed-up excited-state calculations.
J. Comput. Chem., 2017
2015
Statistical analysis of electronic excitation processes: Spatial location, compactness, charge transfer, and electron-hole correlation.
J. Comput. Chem., 2015
2014
Calculating core-level excitations and x-ray absorption spectra of medium-sized closed-shell molecules with the algebraic-diagrammatic construction scheme for the polarization propagator.
J. Comput. Chem., 2014
2013
New implementation of high-level correlated methods using a general block tensor library for high-performance electronic structure calculations.
J. Comput. Chem., 2013
2012
Computational design of improved two-photon active caging compounds based on nitrodibenzofuran.
J. Comput. Chem., 2012
2011
Assessment of TD-DFT- and TD-HF-based approaches for the prediction of exciton coupling parameters, potential energy curves, and electronic characters of electronically excited aggregates.
J. Comput. Chem., 2011