Search results
- 1.0566502 - FZÚ 2023 RIV DE eng J - Journal Article
Fujii, S. - Montes Muñoz, Enrique - Cho, H. - Yue, Y. - Koike, M. - Nishino, T. - Vázquez, Héctor - Kiguchi, M.
Mechanically tuned thermopower of single-molecule junctions.
Advanced Electronic Materials. Roč. 8, č. 12 (2022), č. článku 2200700. ISSN 2199-160X. E-ISSN 2199-160X
R&D Projects: GA MŠMT(CZ) EF16_019/0000760
Grant - others:OP VVV - SOLID21(XE) CZ.02.1.01/0.0/0.0/16_019/0000760
Institutional support: RVO:68378271
Keywords : break junctions * density functional theory * single-molecule junctions * thermopower
OECD category: Condensed matter physics (including formerly solid state physics, supercond.)
Impact factor: 6.2, year: 2022
Method of publishing: Open access
Permanent Link: https://hdl.handle.net/11104/0337819File Download Size Commentary Version Access 0566502.pdf 0 1.3 MB CC licence Publisher’s postprint open-access - 2.0560299 - FZÚ 2023 RIV US eng J - Journal Article
Arasu, Narendra P. - Vázquez, Héctor
Development of classical force fields for interfaces between single molecules and Au.
Journal of Physical Chemistry A. Roč. 126, č. 30 (2022), s. 5031-5039. ISSN 1089-5639. E-ISSN 1520-5215
R&D Projects: GA ČR GA19-23702S
Research Infrastructure: e-INFRA CZ - 90140
Institutional support: RVO:68378271
Keywords : single molecule junctions * force fields * molecular dynamics * DFT * junction structure
OECD category: Condensed matter physics (including formerly solid state physics, supercond.)
Impact factor: 2.9, year: 2022
Method of publishing: Limited access
https://doi.org/10.1021/acs.jpca.2c02514
Permanent Link: https://hdl.handle.net/11104/0333673 - 3.0559773 - ÚFCH JH 2023 AT eng A - Abstract
Vavrek, František - Pospíšil, Lubomír - Nováková Lachmanová, Štěpánka - Kolivoška, Viliam - Šebera, Jakub - Gasior, Jindřich - Mészáros, G. - Kaleta, Jiří - Hromadová, Magdaléna
Flexibility and Rigidity of Molecular Rods Induced by Electron Transfer.
8th Regional Symposium on Electrochemistry of South-East Europe together with the 9th Kurt Schwabe Symposium. Graz: Graz University of Technology, 2022. s. 65-65.
[Regional Symposium on Electrochemistry of South-East Europe /8./ together with the Kurt Schwabe Symposium /9./. 11.07.2022-15.07.2022, Graz]
R&D Projects: GA ČR(CZ) GA21-13458S
Institutional support: RVO:61388955
Keywords : single molecule junctions * quantum interference * molecule electronics
OECD category: Electrochemistry (dry cells, batteries, fuel cells, corrosion metals, electrolysis)
Permanent Link: https://hdl.handle.net/11104/0332975 - 4.0549112 - FZÚ 2022 RIV CH eng J - Journal Article
Montes Muñoz, Enrique - Vázquez, Héctor
Role of the binding motifs in the energy level alignment and conductance of amine-gold linked molecular junctions within DFT and DFT+ Σ.
Applied Sciences-Basel. Roč. 11, č. 2 (2021), č. článku 802. E-ISSN 2076-3417
R&D Projects: GA ČR GA19-23702S; GA MŠMT EF18_070/0010126
Institutional support: RVO:68378271
Keywords : single molecule junctions * metal/molecule interface * energy level alignment * density functional theory * conductance * electron transport * DFT + Σ
OECD category: Condensed matter physics (including formerly solid state physics, supercond.)
Impact factor: 2.838, year: 2021
Method of publishing: Open access
Permanent Link: http://hdl.handle.net/11104/0325142File Download Size Commentary Version Access 0549112.pdf 1 1.7 MB CC Licence Publisher’s postprint open-access - 5.0507903 - FZÚ 2020 RIV GB eng J - Journal Article
Arasu, Narendra P. - Vázquez, Héctor
Direct Au-C contacts based on biphenylene for single molecule circuits.
Physical Chemistry Chemical Physics. Roč. 20, č. 15 (2018), s. 10378-10383. ISSN 1463-9076. E-ISSN 1463-9084
R&D Projects: GA ČR GA15-19672S
Institutional support: RVO:68378271
Keywords : junctions * electronics * single-molecule junctions
OECD category: Condensed matter physics (including formerly solid state physics, supercond.)
Impact factor: 3.567, year: 2018
Method of publishing: Limited access
https://doi.org/10.1039/c8cp00613j
Permanent Link: http://hdl.handle.net/11104/0298866 - 6.0505011 - FZÚ 2020 RIV GB eng J - Journal Article
Montes Muñoz, Enrique - Foti, Giuseppe - Vázquez, Héctor
Crossover in the inelastic electron tunneling spectra of conjugated molecules with direct Au-C links.
Physical Chemistry Chemical Physics. Roč. 21, č. 3 (2019), s. 1564-1571. ISSN 1463-9076. E-ISSN 1463-9084
R&D Projects: GA ČR GA15-19672S
EU Projects: European Commission(XE) 709114 - HEATEXMOL
Institutional support: RVO:68378271
Keywords : junctions | | single-molecule junctions * transport * molecular electronics * single-molecule junctions
OECD category: Condensed matter physics (including formerly solid state physics, supercond.)
Impact factor: 3.430, year: 2019
Method of publishing: Open access
Permanent Link: http://hdl.handle.net/11104/0296538File Download Size Commentary Version Access 0505011.pdf 0 3.7 MB CC licence Publisher’s postprint open-access - 7.0477163 - ÚOCHB 2018 RIV US eng J - Journal Article
Kaleta, Jiří - Bednárová, Lucie - Čížková, Martina - Wen, Jin - Kaletová, Eva - Michl, Josef
IR Spectra of n-Bu4M (M = Si, Ge, Sn, Pb), n-BuAuPPh3-d(15), and ”n-Bu” on a Gold Surface.
Journal of Physical Chemistry A. Roč. 121, č. 24 (2017), s. 4619-4625. ISSN 1089-5639. E-ISSN 1520-5215
R&D Projects: GA ČR GA14-02337S
Institutional support: RVO:61388963
Keywords : single-molecule junctions * alkylation
OECD category: Physical chemistry
Impact factor: 2.836, year: 2017
Permanent Link: http://hdl.handle.net/11104/0273544 - 8.0475038 - ÚFCH JH 2018 CZ eng A - Abstract
Hromadová, Magdaléna - Lachmanová, Štěpánka - Kolivoška, Viliam - Šebera, Jakub - Gasior, Jindřich - Mészáros, G. - Lainé, P. P. - Valášek, M. - Mayor, M.
Charge transport in single molecule junctions.
XVII. Workshop of Physical Chemists and Electrochemists. Book of abstracts. Brno: Masaryk University, 2017 - (Trnková, L.). s. 12-13
[Workshop of Physical Chemists and Electrochemists /17./. 30.05.2017-31.05.2017, Brno]
R&D Projects: GA ČR(CZ) GA14-05180S; GA ČR GJ16-07460Y
Institutional support: RVO:61388955
Keywords : molecular electronics * electrochemistry * single molecule junctions
Subject RIV: CG - Electrochemistry
Permanent Link: http://hdl.handle.net/11104/0271908File Download Size Commentary Version Access 0475038.pdf 1 721.3 KB Publisher’s postprint require - 9.0450212 - ÚOCHB 2016 RIV US eng J - Journal Article
Kaletová, Eva - Kohutová, Anna - Hajduch, Jan - Kaleta, Jiří - Bastl, Zdeněk - Pospíšil, Lubomír - Stibor, Ivan - Magnera, T. F. - Michl, Josef
The Scope of Direct Alkylation of Gold Surface with Solutions of C-1-C-4 n-Alkylstannanes.
Journal of the American Chemical Society. Roč. 137, č. 37 (2015), s. 12086-12099. ISSN 0002-7863. E-ISSN 1520-5126
R&D Projects: GA ČR GA14-02337S
EU Projects: European Commission(XE) 227756 - DIPOLAR ROTOR ARRAY
Institutional support: RVO:61388963 ; RVO:61388955
Keywords : self-assembled monolayers * single-molecule junctions * spectroscopy
Subject RIV: CC - Organic Chemistry; CF - Physical ; Theoretical Chemistry (UFCH-W)
Impact factor: 13.038, year: 2015
http://pubs.acs.org/doi/10.1021/jacs.5b07672
Permanent Link: http://hdl.handle.net/11104/0251694File Download Size Commentary Version Access 0450212.pdf 5 3.4 MB Publisher’s postprint open-access