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David Zsolt Manrique
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Single molecular conductance of tolanes: experimental and theoretical study on the junction evolution dependent on the anchoring group
W Hong, DZ Manrique, P Moreno-García, M Gulcur, A Mishchenko, ...
Journal of the American Chemical Society 134 (4), 2292-2304, 2012
4312012
GOLLUM: a next-generation simulation tool for electron, thermal and spin transport
J Ferrer, CJ Lambert, VM García-Suárez, DZ Manrique, D Visontai, ...
New Journal of Physics 16 (9), 093029, 2014
3432014
Single-molecule conductance of functionalized oligoynes: length dependence and junction evolution
P Moreno-García, M Gulcur, DZ Manrique, T Pope, W Hong, V Kaliginedi, ...
Journal of the American Chemical Society 135 (33), 12228-12240, 2013
3192013
A quantum circuit rule for interference effects in single-molecule electrical junctions
DZ Manrique, C Huang, M Baghernejad, X Zhao, OA Al-Owaedi, ...
Nature communications 6 (1), 6389, 2015
1952015
An MCBJ case study: The influence of π-conjugation on the single-molecule conductance at a solid/liquid interface
W Hong, H Valkenier, G Mészáros, DZ Manrique, A Mishchenko, A Putz, ...
Beilstein journal of nanotechnology 2 (1), 699-713, 2011
1832011
Three‐state single‐molecule naphthalenediimide switch: integration of a pendant redox unit for conductance tuning
Y Li, M Baghernejad, AG Qusiy, D Zsolt Manrique, G Zhang, J Hamill, ...
Angewandte Chemie 127 (46), 13790-13793, 2015
802015
Radical‐Enhanced Charge Transport in Single‐Molecule Phenothiazine Electrical Junctions
J Liu, X Zhao, Q Al‐Galiby, X Huang, J Zheng, R Li, C Huang, Y Yang, ...
Angewandte Chemie 129 (42), 13241-13245, 2017
792017
Solvent dependence of the single molecule conductance of oligoyne-based molecular wires
DC Milan, OA Al-Owaedi, MC Oerthel, S Marqués-González, RJ Brooke, ...
The Journal of Physical Chemistry C 120 (29), 15666-15674, 2016
782016
Correlation of breaking forces, conductances and geometries of molecular junctions
K Yoshida, IV Pobelov, DZ Manrique, T Pope, G Mészáros, M Gulcur, ...
Scientific reports 5 (1), 9002, 2015
592015
Highly-effective gating of single-molecule junctions: an electrochemical approach
M Baghernejad, DZ Manrique, C Li, T Pope, U Zhumaev, I Pobelov, ...
Chemical communications 50 (100), 15975-15978, 2014
542014
Graphene sculpturene nanopores for DNA nucleobase sensing
H Sadeghi, L Algaragholy, T Pope, S Bailey, D Visontai, D Manrique, ...
The Journal of Physical Chemistry B 118 (24), 6908-6914, 2014
512014
A new approach to materials discovery for electronic and thermoelectric properties of single-molecule junctions
DZ Manrique, Q Al-Galiby, W Hong, CJ Lambert
Nano Letters 16 (2), 1308-1316, 2016
502016
Quantum interference in single molecule electronic systems
RE Sparks, VM García-Suárez, DZ Manrique, CJ Lambert
Physical Review B 83 (7), 075437, 2011
492011
Redox control of thermopower and figure of merit in phase-coherent molecular wires
VM García-Suárez, CJ Lambert, DZ Manrique, T Wandlowski
Nanotechnology 25 (20), 205402, 2014
452014
Adverse effects of asymmetric contacts on single molecule conductances of HS (CH2) n COOH in nanoelectrical junctions
S Martin, DZ Manrique, VM Garcia-Suarez, W Haiss, SJ Higgins, ...
Nanotechnology 20 (12), 125203, 2009
452009
Asymmetry-induced resistive switching in Ag-Ag2S-Ag memristors enabling a simplified atomic-scale memory design
A Gubicza, DZ Manrique, L Pósa, CJ Lambert, G Mihály, M Csontos, ...
Scientific reports 6 (1), 30775, 2016
422016
Quantum computational quantification of protein–ligand interactions
JJM Kirsopp, C Di Paola, DZ Manrique, M Krompiec, G Greene‐Diniz, ...
International Journal of Quantum Chemistry 122 (22), e26975, 2022
402022
Structural versus electrical functionalization of oligo (phenylene ethynylene) diamine molecular junctions
MT González, X Zhao, DZ Manrique, D Miguel, E Leary, M Gulcur, ...
The Journal of Physical Chemistry C 118 (37), 21655-21662, 2014
402014
Anisotropic magnetoresistance in atomic chains of iridium and platinum from first principles
VM García-Suárez, DZ Manrique, CJ Lambert, J Ferrer
Physical Review B 79 (6), 060408, 2009
342009
Momentum-space unitary coupled cluster and translational quantum subspace expansion for periodic systems on quantum computers
DZ Manrique, IT Khan, K Yamamoto, V Wichitwechkarn, DM Ramo
arXiv preprint arXiv:2008.08694, 2020
282020
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