Miklos Kertesz
Miklos Kertesz
Professor of Chemistry, Georgetown University
Verified email at - Homepage
Cited by
Cited by
Carbon nanotube actuators
RH Baughman, C Cui, AA Zakhidov, Z Iqbal, JN Barisci, GM Spinks, ...
Science 284 (5418), 1340-1344, 1999
Structure‐property predictions for new planar forms of carbon: Layered phases containing sp2 and sp atoms
RH Baughman, H Eckhardt, M Kertesz
The Journal of chemical physics 87 (11), 6687-6699, 1987
Conjugated polymers and aromaticity
M Kertesz, CH Choi, S Yang
Chemical reviews 105 (10), 3448-3481, 2005
Conformational information from vibrational spectra of styrene, trans-stilbene, and cis-stilbene
CH Choi, M Kertesz
The Journal of Physical Chemistry A 101 (20), 3823-3831, 1997
Single-Bond Torsional Potentials in Conjugated Systems:  A Comparison of ab Initio and Density Functional Results
A Karpfen, CH Choi, M Kertesz
The Journal of Physical Chemistry A 101 (40), 7426-7433, 1997
Octahedral vs. trigonal-prismatic coordination and clustering in transition-metal dichalcogenides
M Kertesz, R Hoffmann
Journal of the American Chemical Society 106 (12), 3453-3460, 1984
Performance of the Vienna ab initio simulation package (VASP) in chemical applications
G Sun, J Kürti, P Rajczy, M Kertesz, J Hafner, G Kresse
Journal of Molecular Structure: THEOCHEM 624 (1-3), 37-45, 2003
Electronic structure of polymers
M Kertész
Advances in quantum chemistry 15, 161-214, 1982
The geometry and the radial breathing mode of carbon nanotubes: beyond the ideal behaviour
J Kürti, V Zólyomi, M Kertesz, G Sun
New Journal of Physics 5 (1), 125, 2003
Hypothetical metallic allotrope of carbon
R Hoffmann, T Hughbanks, M Kertesz, PH Bird
Journal of the American Chemical Society 105 (14), 4831-4832, 1983
Bandgap calculations for conjugated polymers
S Yang, P Olishevski, M Kertesz
Synthetic Metals 141 (1-2), 171-177, 2004
The effects of electron correlation on the degree of bond alternation and electronic structure of oligomers of polyacetylene
C Ho Choi, M Kertesz, A Karpfen
The Journal of chemical physics 107 (17), 6712-6721, 1997
Two helical conformations of polythiophene, polypyrrole, and their derivatives
CX Cui, M Kertesz
Physical Review B 40 (14), 9661, 1989
Intermolecular transfer integrals for organic molecular materials: can basis set convergence be achieved?
J Huang, M Kertesz
Chemical physics letters 390 (1-3), 110-115, 2004
Bond length alternation and energy band gap of polyyne
S Yang, M Kertesz
The Journal of Physical Chemistry A 110 (31), 9771-9774, 2006
Intermolecular covalent π− π bonding interaction indicated by bond distances, energy bands, and magnetism in biphenalenyl biradicaloid molecular crystal
J Huang, M Kertesz
Journal of the American Chemical Society 129 (6), 1634-1643, 2007
Evidence of σ-and π-Dimerization in a Series of Phenalenyls
Z Mou, K Uchida, T Kubo, M Kertesz
Journal of the American Chemical Society 136 (52), 18009-18022, 2014
Pancake bonding: an unusual pi‐stacking interaction
M Kertesz
Chemistry–A European Journal 25 (2), 400-416, 2019
Metal oligo-yne polymers: electronic structures of [-(L) nMC. tplbond. CRC. tplbond. C-] x polymers
G Frapper, M Kertesz
Inorganic Chemistry 32 (5), 732-740, 1993
Higher order Peierls distortion of one-dimensional carbon skeletons
M Kertesz, R Hoffmann
Solid state communications 47 (2), 97-102, 1983
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