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Jan Hamaekers
Jan Hamaekers
Fraunhofer Institute for Algorithms and Scientific Computing SCAI
在 scai.fraunhofer.de 的电子邮件经过验证
标题
引用次数
引用次数
年份
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
4692004
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
1822007
Sparse grids for the Schrödinger equation
M Griebel, J Hamaekers
ESAIM: Mathematical Modelling and Numerical Analysis 41 (2), 215-247, 2007
1332007
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
1112017
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
1112017
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
902008
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
892011
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
742009
Fast Discrete Fourier Transform on Generalized Sparse Grids
M Griebel, J Hamaekers
Sparse Grids and Applications-Munich 2012, 75-107, 2014
482014
Fast discrete Fourier transform on generalized sparse grids
M Griebel, J Hamaekers
Sparse Grids and Applications-Munich 2012, 75-107, 2014
482014
Molecular dynamics simulations of boron-nitride nanotubes embedded in amorphous Si-BN
M Griebel, J Hamaekers
Computational materials science 39 (3), 502-517, 2007
402007
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
362010
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
242006
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
212005
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
202018
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
162009
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
132015
Biomolecules as soft matter surfaces
AM Bittner, F Heber, J Hamaekers
Surface Science 603 (10-12), 1922-1925, 2009
132009
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
122021
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