Molecular dynamics simulations of the elastic moduli of polymer–carbon nanotube composites M Griebel, J Hamaekers Computer methods in applied mechanics and engineering 193 (17-20), 1773-1788, 2004 | 469 | 2004 |
A molecular dynamic study of cementitious calcium silicate hydrate (C–S–H) gels JS Dolado, M Griebel, J Hamaekers Journal of the American Ceramic Society 90 (12), 3938-3942, 2007 | 182 | 2007 |
Sparse grids for the Schrödinger equation M Griebel, J Hamaekers ESAIM: Mathematical Modelling and Numerical Analysis 41 (2), 215-247, 2007 | 133 | 2007 |
ATK-ForceField: a new generation molecular dynamics software package J Schneider, J Hamaekers, ST Chill, S Smidstrup, J Bulin, R Thesen, ... Modelling and Simulation in Materials Science and Engineering 25 (8), 085007, 2017 | 111 | 2017 |
ATK-ForceField: a new generation molecular dynamics software package J Schneider, J Hamaekers, ST Chill, S Smidstrup, J Bulin, R Thesen, ... Modelling and Simulation in Materials Science and Engineering 25 (8), 085007, 2017 | 111 | 2017 |
A molecular dynamics study of the aluminosilicate chains structure in Al‐rich calcium silicate hydrated (C–S–H) gels H Manzano, JS Dolado, M Griebel, J Hamaekers physica status solidi (a) 205 (6), 1324-1329, 2008 | 90 | 2008 |
The nano-branched structure of cementitious calcium–silicate–hydrate gel JS Dolado, M Griebel, J Hamaekers, F Heber Journal of Materials Chemistry 21 (12), 4445-4449, 2011 | 89 | 2011 |
A molecular dynamics study on the impact of defects and functionalization on the Young modulus of boron–nitride nanotubes M Griebel, J Hamaekers, F Heber Computational Materials Science 45 (4), 1097-1103, 2009 | 74 | 2009 |
Fast Discrete Fourier Transform on Generalized Sparse Grids M Griebel, J Hamaekers Sparse Grids and Applications-Munich 2012, 75-107, 2014 | 48 | 2014 |
Fast discrete Fourier transform on generalized sparse grids M Griebel, J Hamaekers Sparse Grids and Applications-Munich 2012, 75-107, 2014 | 48 | 2014 |
Molecular dynamics simulations of boron-nitride nanotubes embedded in amorphous Si-BN M Griebel, J Hamaekers Computational materials science 39 (3), 502-517, 2007 | 40 | 2007 |
Tensor product multiscale many-particle spaces with finite-order weights for the electronic Schrödinger equation M Griebel, J Hamaekers Zeitschrift für Physikalische Chemie 224 (3-4), 527-543, 2010 | 36 | 2010 |
A wavelet based sparse grid method for the electronic Schrödinger equation M Griebel, J Hamaekers Proceedings oh the International Congress of Mathematicians: Madrid, August …, 2006 | 24 | 2006 |
LC-GAP: Localized Coulomb Descriptors for the Gaussian Approximation Potential J Barker, J Bulin, J Hamaekers, S Mathias INS Preprint 1604, Institute for Numerical Simulation, University of Bonn …, 2016 | 21* | 2016 |
Molecular dynamics simulations of the mechanical properties of polyethylene-carbon nanotube composites M Griebel, J Hamaekers Handbook of Theoretical and Computational Nanotechnology 9, 409-454, 2005 | 21 | 2005 |
Insights into the Folding of Disulfide-Rich μ-Conotoxins AA Paul George, P Heimer, A Maaß, J Hamaekers, M Hofmann-Apitius, ... ACS Omega 3 (10), 12330-12340, 2018 | 20 | 2018 |
Tensor product multiscale many-particle spaces with finite-order weights for the electronic Schrödinger equation J Hamaekers Doktorarbeit, Institut für Numerische Simulation, Universität Bonn, 2009 | 16 | 2009 |
A Finite Element Study on the Effect of Curvature on the Reinforcement of Matrices by Randomly Distributed and Curved Nanotubes D Christian, D Dirk, H Jan, H Bjoern, R Maharavo Journal of Computational and Theoretical Nanoscience 12 (9), 2108-2116, 2015 | 13 | 2015 |
Biomolecules as soft matter surfaces AM Bittner, F Heber, J Hamaekers Surface Science 603 (10-12), 1922-1925, 2009 | 13 | 2009 |
Rapid Prescreening of Organic Compounds for Redox Flow Batteries: A Graph Convolutional Network for Predicting Reaction Enthalpies from SMILES J Barker, LS Berg, J Hamaekers, A Maass Batteries & Supercaps 4 (9), 1482-1490, 2021 | 12 | 2021 |