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2020 – today
- 2021
[j12]Lukas N. Wirz
, Peter Schwerdtfeger, James Avery:
Calculating the number of Hamilton cycles in layered polyhedral graphs. Comput. Math. Methods 3(4) (2021)
2010 – 2019
- 2019
- [j11]Paul Jerabek, Peter Schwerdtfeger, Gernot Frenking:
Dative and electron-sharing bonding in transition metal compounds. J. Comput. Chem. 40(1): 247-264 (2019) - 2016
- [j10]Lukas N. Wirz, Ralf Tonner, Andreas Hermann, Rebecca Sure, Peter Schwerdtfeger:
From small fullerenes to the graphene limit: A harmonic force-field method for fullerenes and a comparison to density functional calculations for Goldberg-Coxeter fullerenes up to C980. J. Comput. Chem. 37(1): 10-17 (2016) - 2015
- [j9]Rebecca Sure, Ralf Tonner, Peter Schwerdtfeger:
A systematic study of rare gas atoms encapsulated in small fullerenes using dispersion corrected density functional theory. J. Comput. Chem. 36(2): 88-96 (2015) - 2014
- [j8]Lukas Wirz, Ralf Tonner, James Avery, Peter Schwerdtfeger:
Structure and Properties of the Nonface-Spiral Fullerenes T-C380, D3-C384, D3-C440, and D3-C672 and Their Halma and Leapfrog Transforms. J. Chem. Inf. Model. 54(1): 121-130 (2014) - 2013
- [j7]Peter Schwerdtfeger, Lukas Wirz, James Avery:
Program fullerene - a software package for constructing and analyzing structures of regular fullerenes. J. Comput. Chem. 34(17): 1508-1526 (2013) - [j6]Daniel A. Götz, Rolf Schäfer, Peter Schwerdtfeger:
The performance of density functional and wavefunction-based methods for 2D and 3D structures of Au10. J. Comput. Chem. 34(23): 1975-1981 (2013) - 2012
- [j5]Xiao-Jing Liu, Ian P. Hamilton, Robert P. Krawczyk, Peter Schwerdtfeger:
The stability of small helical gold nanorods: A relativistic density functional study. J. Comput. Chem. 33(3): 311-318 (2012) - 2011
- [c1]Tobias Meyer, Jakob Unger, Peter Schwerdtfeger, Michael Döllinger, Jörg Lohscheller:
Impact of rigid endoscopic laryngoscopy on electroglottographic and acoustic parameters. MAVEBA 2011: 107-109 - 2010
- [j4]Behnam Assadollahzadeh, Sascha Schäfer, Peter Schwerdtfeger:
Electronic properties for small tin clusters Snn (n <= 20) from density functional theory and the convergence toward the solid state. J. Comput. Chem. 31(5): 929-937 (2010)
2000 – 2009
- 2002
- [j3]Peter Schwerdtfeger:
Interpretation of airborne observations of the Albedo. Environ. Model. Softw. 17(1): 51-60 (2002) - [j2]Jochen Autschbach, S. Siekierski, M. Seth, Peter Schwerdtfeger, W. H. E. Schwarz:
Dependence of relativistic effects on electronic configuration in the neutral atoms of d- and f-block elements. J. Comput. Chem. 23(8): 804-813 (2002)
1990 – 1999
- 1993
- [j1]Peter Schwerdtfeger, Josef Ischtwan:
Theoretical investigations on thallium halides: Relativistic and electron correlation effects in T1X and T1X3 compounds (X&[DOUBLE BOND];F, C1, Br, and I). J. Comput. Chem. 14(8): 913-921 (1993)
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