Lehrstuhl für Theoretische Chemie

Reduction of π-Expanded Cyclooctatetraene with Lithium: Stabilization of the Tetra-Anion through Internal Li+ Coordination (2020) Zhou Z, Zhu Y, Wei Z, Bergner J, Neiß C, Doloczki S, Görling A, et al. Journal article Lieb-Oxford bound and pair correlation functions for density-functional methods based on the adiabatic-connection fluctuation-dissipation theorem (2020) Erhard J, Fauser S, Moerman E, Kalaß S, Trushin E, Görling A Journal article Mixed Organic Ligand Shells: Controlling the Nanoparticle Surface Morphology toward Tuning the Optoelectronic Properties (2020) Henkel C, Wittmann J, Träg J, Will J, Stiegler L, Strohriegl P, Hirsch A, et al. Journal article Parallel generalized real symmetric-definite eigenvalue problem (2020) Sims JS, Ruiz MB Journal article Quantifying how step-wise fluorination tunes local solute hydrophobicity, hydration shell thermodynamics and the quantum mechanical contributions of solute-water interactions (2020) Robalo JR, Mendes De Oliveira D, Imhof P, Ben-Amotz D, Vila Verde A Journal article Area-Selective Growth of HfS(2)Thin Films via Atomic Layer Deposition at Low Temperature (2020) Cao Y, Wähler T, Park H, Will J, Prihoda A, Moses Badlyan N, Fromm L, et al. Journal article Area-Selective Growth of HfS(2)Thin Films via Atomic Layer Deposition at Low Temperature (2020) Cao Y, Wähler T, Park H, Will J, Prihoda A, Moses Badlyan N, Fromm L, et al. Journal article Polar Structure Formation in Solid Solution of Strontium-Substituted Fluorapatite-Gelatin Composites: From Structural and Morphogenetic Aspects to Pyroelectric Properties (2020) Knaus J, Sommer M, Duchstein P, Gumeniuk R, Akselrud L, Sturm S, Auffermann G, et al. Journal article Interface between Water-Solvent Mixtures and a Hydrophobic Surface (2020) Prihoda A, Will J, Duchstein P, Becit B, Lossin F, Schindler T, Berlinghof M, et al. Journal article Analytic energy gradients for the self-consistent direct random phase approximation (2020) Thierbach A, Görling A Journal article