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Journal of Computational Chemistry|July 20, 2019
Density functional theory for molecular and periodic systems using density fitting and continuous fast multipole method: Stress tensorMartin Becker, Marek SierkaMaterials (Basel, Switzerland)|August 25, 2019
Atomistic Simulations of Plasma-Enhanced Atomic Layer DepositionMartin Becker, Marek SierkaJournal of Computational Chemistry|October 15, 2011
Similarity recognition of molecular structures by optimal atomic matching and rotational superpositionBenjamin Helmich, Marek SierkaJournal of Chemical Theory and Computation|October 17, 2024
Optical Gaps of Ionic Materials from GW/BSE-in-DFT and CC2-in-DFTManas Sharma, Marek SierkaJournal of Chemical Theory and Computation|October 12, 2022
Efficient Implementation of Density Functional Theory Based Embedding for Molecular and Periodic Systems Using Gaussian Basis FunctionsManas Sharma, Marek SierkaJournal of Chemical Theory and Computation|November 25, 2015
Linear Scaling Hierarchical Integration Scheme for the Exchange-Correlation Term in Molecular and Periodic SystemsAsbjörn M Burow, Marek SierkaJournal of Computational Chemistry|January 19, 2021
Real-time time-dependent density functional theory using density fitting and the continuous fast multipole methodCarolin Müller, Manas Sharma, Marek SierkaPhysical Chemistry Chemical Physics : PCCP|October 2, 2015
Dynamics of ultrathin gold layers on vitreous silica probed by density functional theoryCarolin Hühn, Lothar Wondraczek, Marek SierkaJournal of Computational Chemistry|July 17, 2008
Application of semiempirical long-range dispersion corrections to periodic systems in density functional theoryTorsten Kerber, Marek Sierka, Joachim SauerPhysical Chemistry Chemical Physics : PCCP|October 11, 2007
Theoretical studies of Cu(I) sites in faujasite and their interaction with carbon monoxidePawel Rejmak, Marek Sierka, Joachim SauerPageof 18