Determination of pKa Values via ab initio Molecular Dynamics and its Application to Transition Metal-Based Water Oxidation Catalysts

Description

Toolbox-ID

jz000074-0041

Identifier(s)

https://tustorage.ulb.tu-darmstadt.de/handle/tustorage/6074

Publisher

MDPI AG

License

https://creativecommons.org/licenses/by/4.0/

Subject(s)

DDC(s)

540