Research Group Prof. Griebel

Publications of Dr. Frederik Heber:

[1] F. Heber. Ein systematischer, linear skalierender Fragmentansatz f"ur das Elektronenstrukturproblem. Dissertation, Institut für Numerische Simulation, Universität Bonn, Feb. 2014.
[ bib | .pdf 1 ]

[2] M. Griebel, J. Hamaekers, and F. Heber. A bond order dissection ANOVA approach for efficient electronic structure calculations. In Extraction of Quantifiable Information from Complex Systems, volume 102 of Lecture Notes in Computational Science and Engineering, pages 211-235. Springer, 2014. also available as INS Preprint No. 1402.
[ bib | .pdf 1 ]

[3] J. Gaitero, J. Dolado, C. Neuen, F. Heber, and E. Koenders. Computational 3d simulation of calcium leaching in cement matrices. In Proceedings of the Second International Conference on Microstructural-related Durability of Cementitious Composites, RILEM, 2012. Also available as INS Preprint no 1203.
[ bib | .pdf 1 ]

[4] J. S. Dolado, M. Griebel, J. Hamaekers, and F. Heber. The nano-branched structure of cementitious calcium-silicate-hydrate gel. Journal of Materials Chemistry, 21:4445-4449, 2011.
[ bib | DOI | http | .pdf 1 ]

[5] M. Griebel, J. Hamaekers, and F. Heber. BOSSANOVA - A bond order dissection approach for efficient electronic structure calculations. Oberwolfach Report, 32:1804-1808, 2011.
[ bib | DOI ]

[6] A. M. Bittner, F. Heber, and J. Hamaekers. Biomolecules as soft matter surfaces. Surface Science, 603:1922-1925, 2009.
[ bib | DOI | http ]

[7] M. Griebel, J. Hamaekers, and F. Heber. A molecular dynamics study on the impact of defects and functionalization on the Young modulus of boron-nitride nanotubes. Computational Materials Science, 45(4):1097-1103, 2009.
[ bib | .pdf 1 ]

[8] M. Griebel and F. Heber. A molecular dynamics study on fullerene-implanted carbon nanotori as electronmagnetic sensing and emitting devices. 2009. INS Preprint no 0912.
[ bib | .pdf 1 ]

[9] M. Griebel, J. Hamaekers, and F. Heber. BOSSANOVA: A bond order dissection approach for efficient electronic structure calculations. INS Preprint 0704, Institut für Numerische Simulation, Universität Bonn, 2008.
[ bib | .pdf 1 ]

[10] F. Heber. Dichtefunktionaltheorie mit elektromagnetischen Effekten und ihre Anwendung. Diplomarbeit, Institut für Numerische Simulation, Universität Bonn, Nov. 2006.
[ bib | .pdf 1 ]

[1]	F. Heber. Ein systematischer, linear skalierender Fragmentansatz f"ur das Elektronenstrukturproblem. Dissertation, Institut für Numerische Simulation, Universität Bonn, Feb. 2014. [ bib \| .pdf 1 ]
[2]	M. Griebel, J. Hamaekers, and F. Heber. A bond order dissection ANOVA approach for efficient electronic structure calculations. In Extraction of Quantifiable Information from Complex Systems, volume 102 of Lecture Notes in Computational Science and Engineering, pages 211-235. Springer, 2014. also available as INS Preprint No. 1402. [ bib \| .pdf 1 ]
[3]	J. Gaitero, J. Dolado, C. Neuen, F. Heber, and E. Koenders. Computational 3d simulation of calcium leaching in cement matrices. In Proceedings of the Second International Conference on Microstructural-related Durability of Cementitious Composites, RILEM, 2012. Also available as INS Preprint no 1203. [ bib \| .pdf 1 ]
[4]	J. S. Dolado, M. Griebel, J. Hamaekers, and F. Heber. The nano-branched structure of cementitious calcium-silicate-hydrate gel. Journal of Materials Chemistry, 21:4445-4449, 2011. [ bib \| DOI \| http \| .pdf 1 ]
[5]	M. Griebel, J. Hamaekers, and F. Heber. BOSSANOVA - A bond order dissection approach for efficient electronic structure calculations. Oberwolfach Report, 32:1804-1808, 2011. [ bib \| DOI ]
[6]	A. M. Bittner, F. Heber, and J. Hamaekers. Biomolecules as soft matter surfaces. Surface Science, 603:1922-1925, 2009. [ bib \| DOI \| http ]
[7]	M. Griebel, J. Hamaekers, and F. Heber. A molecular dynamics study on the impact of defects and functionalization on the Young modulus of boron-nitride nanotubes. Computational Materials Science, 45(4):1097-1103, 2009. [ bib \| .pdf 1 ]
[8]	M. Griebel and F. Heber. A molecular dynamics study on fullerene-implanted carbon nanotori as electronmagnetic sensing and emitting devices. 2009. INS Preprint no 0912. [ bib \| .pdf 1 ]
[9]	M. Griebel, J. Hamaekers, and F. Heber. BOSSANOVA: A bond order dissection approach for efficient electronic structure calculations. INS Preprint 0704, Institut für Numerische Simulation, Universität Bonn, 2008. [ bib \| .pdf 1 ]
[10]	F. Heber. Dichtefunktionaltheorie mit elektromagnetischen Effekten und ihre Anwendung. Diplomarbeit, Institut für Numerische Simulation, Universität Bonn, Nov. 2006. [ bib \| .pdf 1 ]