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Molecular Transport Group

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Scopus Author ID: 7003505397
ResearcherID: G-5788-2014

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Employment (1)

Inst. of Physics, Academy of Sciences of the Czech Republic: Prague, CZ

Senior Scientist
Employment
Source: Self-asserted source
Héctor Vázquez

Education and qualifications (1)

Universidad Autónoma de Madrid: Madrid, Madrid, ES

PhD (Department of Theoretical Condensed Matter Physics)
Education
Source: Self-asserted source
Héctor Vázquez

Funding (4)

Design and Control of Single Molecule Junctions

2023-01-04 to 2026-12-31 | Grant
Ministry of Education Youth and Sports (Prague, CZ)
URL: https://app.dimensions.ai/details/grant/grant.13583738
GRANT_NUMBER: 8I23002
Source: Self-asserted source
Héctor Vázquez via DimensionsWizard

Design of molecular circuits from simulations and machine learning

2023-01-01 to 2025-12-31 | Grant
Czech Science Foundation (Prague, CZ)
URL: https://app.dimensions.ai/details/grant/grant.13584829
GRANT_NUMBER: GA23-05891S
Source: Self-asserted source
Héctor Vázquez via DimensionsWizard

Vývoj vodivosti skrze jednu molekulu z prvních principů

2019-01 to 2021-12 | Grant
Grantová Agentura České Republiky (Prague, CZ)
GRANT_NUMBER: GA19-23702S
Source: Self-asserted source
Héctor Vázquez

Síly a vodivost v molekulárních kontaktech

2015-01-01 to 2017-12-31 | Grant
Czech Science Foundation (Prague, CZ)
URL: https://grants.uberresearch.com/501100001824/GA15-19672S/Forces-and-conductivity-in-molecular-contacts
GRANT_NUMBER: GA15-19672S
Source: Self-asserted source
Héctor Vázquez via DimensionsWizard
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Works (50 of 55)

Items per page:
Page 1 of 2

Resolving molecular frontier orbitals in molecular junctions with kHz resolution

Chemical Science
2024 | Journal article
DOI: 10.1039/D4SC05285D
Contributors: Yuji Isshiki; Enrique Montes; Tomoaki Nishino; Héctor Vázquez; Shintaro Fujii
Source: check_circle
Crossref

α,ω-Alkanedibromides Form Low Conductance Chemisorbed Junctions with Silver Electrodes

Journal of the American Chemical Society
2024-10-04 | Journal article
DOI: 10.1021/jacs.4c11241
Contributors: Thomas M. Czyszczon-Burton; Enrique Montes; Jazmine Prana; Sawyer Lazar; Nils Rotthowe; Sully F. Chen; Héctor Vázquez; Michael S. Inkpen
Source: check_circle
Crossref

Graphene edge interference improves single-molecule transistors

Nature Nanotechnology
2024-07 | Journal article
DOI: 10.1038/s41565-024-01634-0
Contributors: Héctor Vázquez
Source: check_circle
Crossref

Cooperative Self-Assembly of Dimer Junctions Driven by π Stacking Leads to Conductance Enhancement

Nano Letters
2023-08-09 | Journal article
DOI: 10.1021/acs.nanolett.3c01540
Contributors: Xiaoyun Pan; Enrique Montes; Wudmir Y. Rojas; Brent Lawson; Héctor Vázquez; Maria Kamenetska
Source: check_circle
Crossref

Mechanically Tuned Thermopower of Single‐Molecule Junctions

Advanced Electronic Materials
2022-12 | Journal article
DOI: 10.1002/aelm.202200700
Contributors: Shintaro Fujii; Enrique Montes; Haruna Cho; Yi Yue; Masaaki Koike; Tomoaki Nishino; Héctor Vázquez; Manabu Kiguchi
Source: check_circle
Crossref
grade
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Toward Density-Functional Theory-Based Structure–Conductance Relationships in Single Molecule Junctions

The Journal of Physical Chemistry Letters
2022-10-13 | Journal article
DOI: 10.1021/acs.jpclett.2c02349
Contributors: Héctor Vázquez
Source: check_circle
Crossref
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Development of Classical Force Fields for Interfaces between Single Molecules and Au

The Journal of Physical Chemistry A
2022-08-04 | Journal article
DOI: 10.1021/acs.jpca.2c02514
Contributors: Narendra P. Arasu; Héctor Vázquez
Source: check_circle
Crossref

Doping of the hydrogen-passivated Si(100) electronic structure through carborane adsorption studied using density functional theory

Physical Chemistry Chemical Physics
2021 | Journal article
DOI: 10.1039/D1CP01654G
Contributors: Martin Hladík; Antonín Fejfar; Héctor Vázquez
Source: check_circle
Crossref

Preservation of the donor–acceptor character of a carbazole–phenalenone dyad upon adsorption on Pt(111)

Nanoscale Advances
2021 | Journal article
DOI: 10.1039/D0NA00925C
Contributors: René Ebeling; Narendra P. Arasu; Lisa Bensch; Bertram Schulze Lammers; Bernhard Mayer; Thomas J. J. Müller; Héctor Vázquez; Silvia Karthäuser
Source: check_circle
Crossref

Calculation of Energy Level Alignment and Interface Electronic Structure in Molecular Junctions beyond DFT

The Journal of Physical Chemistry C
2021-11-25 | Journal article
DOI: 10.1021/acs.jpcc.1c07407
Contributors: Enrique Montes; Héctor Vázquez
Source: check_circle
Crossref

Origin of the Electron Transport Properties of Aromatic and Antiaromatic Single Molecule Circuits

ChemPhysChem
2021-05-05 | Journal article
DOI: 10.1002/cphc.202100010
Contributors: Narendra P. Arasu; Héctor Vázquez
Source: check_circle
Crossref

On‐Surface Synthesis of Polyferrocenylene and its Single‐Chain Conformational and Electrical Transport Properties

Advanced Functional Materials
2021-01 | Journal article
DOI: 10.1002/adfm.202006391
Part of ISSN: 1616-301X
Part of ISSN: 1616-3028
Contributors: Vijai M. Santhini; Oleksandr Stetsovych; Martin Ondráček; Jesus I. Mendieta Moreno; Pingo Mutombo; Bruno de la Torre; Martin Švec; Jiří Klívar; Irena G. Stará; Héctor Vázquez et al.
Source: Self-asserted source
Héctor Vázquez

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
2021-01-15 | Journal article
DOI: 10.3390/app11020802
Contributors: Enrique Montes; Héctor Vázquez
Source: check_circle
Crossref
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Cyclopropenylidenes as Strong Carbene Anchoring Groups on Au Surfaces

Journal of the American Chemical Society
2020-11-25 | Journal article | Author
DOI: 10.1021/jacs.0c10743
Part of ISSN: 0002-7863
Part of ISSN: 1520-5126
Contributors: Evan A. Doud; Rachel Starr; Gregor Kladnik; Anastasia Voevodin; Enrique Montes; Narendra P. Arasu; Yaping Zang; Percy Zahl; Alberto Morgante; Latha Venkataraman et al.
Source: Self-asserted source
Héctor Vázquez

Crossover in the inelastic electron tunneling spectra of conjugated molecules with direct Au–C links

Physical Chemistry Chemical Physics
2019 | Journal article
DOI: 10.1039/C8CP06290K
Contributors: Enrique Montes; Giuseppe Foti; Héctor Vázquez
Source: check_circle
Crossref

Identifying the molecular adsorption site of a single molecule junction through combined Raman and conductance studies

Chemical Science
2019 | Journal article
DOI: 10.1039/C9SC00701F
Contributors: Satoshi Kaneko; Enrique Montes; Sho Suzuki; Shintaro Fujii; Tomoaki Nishino; Kazuhito Tsukagoshi; Katsuyoshi Ikeda; Hideaki Kano; Hisao Nakamura; Héctor Vázquez et al.
Source: check_circle
Crossref

Tuning of the gold work function by carborane films studied using density functional theory

Physical Chemistry Chemical Physics
2019 | Journal article
DOI: 10.1039/C9CP00346K
Contributors: Martin Hladík; Aliaksei Vetushka; Antonín Fejfar; Héctor Vázquez
Source: check_circle
Crossref

Direct Au-C contacts based on biphenylene for single molecule circuits

Phys. Chem. Chem. Phys.
2018 | Journal article
DOI: 10.1039/C8CP00613J
Source: Self-asserted source
Héctor Vázquez
grade
Preferred source (of 2)‎

Large Converse Piezoelectric Effect Measured on a Single Molecule on a Metallic Surface

Journal of the American Chemical Society
2018 | Journal article
DOI: 10.1021/jacs.7b08729
ARXIV:

https://doi.org/10.1021/jacs.7b08729

Source: Self-asserted source
Héctor Vázquez

In Situ Formation of N-Heterocyclic Carbene-Bound Single-Molecule Junctions

Journal of the American Chemical Society
2018-07-18 | Journal article
DOI: 10.1021/jacs.8b05184
Contributors: Evan A. Doud; Michael S. Inkpen; Giacomo Lovat; Enrique Montes; Daniel W. Paley; Michael L. Steigerwald; Héctor Vázquez; Latha Venkataraman; Xavier Roy
Source: check_circle
Crossref

Origin of Vibrational Instabilities in Molecular Wires with Separated Electronic States

The Journal of Physical Chemistry Letters
2018-06-07 | Journal article
DOI: 10.1021/acs.jpclett.8b00940
Contributors: Giuseppe Foti; Héctor Vázquez
Source: check_circle
Crossref

Adsorbate-driven cooling of carbene-based molecular junctions

Beilstein Journal of Nanotechnology
2017-10 | Journal article
DOI: 10.3762/bjnano.8.206
EID:

2-s2.0-85031429616
Source: Self-asserted source
Héctor Vázquez
grade
Preferred source (of 2)‎

Submolecular Resolution by Variation of the Inelastic Electron Tunneling Spectroscopy Amplitude and its Relation to the AFM/STM Signal

Physical Review Letters
2017-10 | Journal article
DOI: 10.1103/PhysRevLett.119.166001
EID:

2-s2.0-85031912552
Source: Self-asserted source
Héctor Vázquez
grade
Preferred source (of 2)‎

Highly-conducting molecular circuits based on antiaromaticity

Nature Communications
2017-07 | Journal article
DOI: 10.1038/ncomms15984
EID:

2-s2.0-85025145356
Source: Self-asserted source
Héctor Vázquez
grade
Preferred source (of 2)‎

Stable Au-C bonds to the substrate for fullerene-based nanostructures

Beilstein Journal of Nanotechnology
2017-05 | Journal article
DOI: 10.3762/bjnano.8.109
EID:

2-s2.0-85020687905
Source: Self-asserted source
Héctor Vázquez
grade
Preferred source (of 2)‎

Interface Tuning of Current-Induced Cooling in Molecular Circuits

Journal of Physical Chemistry C
2017-01 | Journal article
DOI: 10.1021/acs.jpcc.6b11955
EID:

2-s2.0-85020042637
Source: Self-asserted source
Héctor Vázquez
grade
Preferred source (of 2)‎

Mapping the intramolecular contributions to the inelastic electron tunneling signal of a molecular junction

Physical Review B - Condensed Matter and Materials Physics
2016 | Journal article
DOI: 10.1103/PhysRevB.94.045418
EID:

2-s2.0-84978401597
Contributors: Foti, G.; Vázquez, H.
Source: Self-asserted source
Héctor Vázquez via Scopus - Elsevier

Tip-induced gating of molecular levels in carbene-based junctions

Nanotechnology
2016 | Journal article
DOI: 10.1088/0957-4484/27/12/125702
EID:

2-s2.0-84959214789
Contributors: Foti, G.; Vázquez, H.
Source: Self-asserted source
Héctor Vázquez via Scopus - Elsevier

Identifying highly conducting Au-C links through inelastic electron tunneling spectroscopy

Journal of Physical Chemistry C
2014 | Journal article
DOI: 10.1021/jp5077824
EID:

2-s2.0-84914694659
Contributors: Foti, G.; Vázquez, H.; Sánchez-Portal, D.; Arnau, A.; Frederiksen, T.
Source: Self-asserted source
Héctor Vázquez via Scopus - Elsevier

Calculation of rates of exciton dissociation into hot charge-transfer states in model organic photovoltaic interfaces

Physical Review B - Condensed Matter and Materials Physics
2013 | Journal article
DOI: 10.1103/PhysRevB.88.205304
EID:

2-s2.0-84887597274
Contributors: Vázquez, H.; Troisi, A.
Source: Self-asserted source
Héctor Vázquez via Scopus - Elsevier

Conductance of molecular junctions formed with silver electrodes

Nano Letters
2013 | Journal article
DOI: 10.1021/nl401654s
EID:

2-s2.0-84880165763
Contributors: Kim, T.; Vázquez, H.; Hybertsen, M.S.; Venkataraman, L.
Source: Self-asserted source
Héctor Vázquez via Scopus - Elsevier

Length-dependent thermopower of highly conducting Au-C bonded single molecule junctions

Nano Letters
2013 | Journal article
DOI: 10.1021/nl4012276
EID:

2-s2.0-84879095643
Contributors: Widawsky, J.R.; Chen, W.; Vázquez, H.; Kim, T.; Breslow, R.; Hybertsen, M.S.; Venkataraman, L.
Source: Self-asserted source
Héctor Vázquez via Scopus - Elsevier

Probing the conductance superposition law in single-molecule circuits with parallel paths

Nature Nanotechnology
2012 | Journal article
DOI: 10.1038/nnano.2012.147
EID:

2-s2.0-84871084057
Contributors: Vazquez, H.; Skouta, R.; Schneebeli, S.; Kamenetska, M.; Breslow, R.; Venkataraman, L.; Hybertsen, M.S.
Source: Self-asserted source
Héctor Vázquez via Scopus - Elsevier

Quantifying through-space charge transfer dynamics in π-coupled molecular systems

Nature Communications
2012 | Journal article
DOI: 10.1038/ncomms2083
EID:

2-s2.0-84866996396
Contributors: Batra, A.; Kladnik, G.; Vázquez, H.; Meisner, J.S.; Floreano, L.; Nuckolls, C.; Cvetko, D.; Morgante, A.; Venkataraman, L.
Source: Self-asserted source
Héctor Vázquez via Scopus - Elsevier

Voltage-dependent conductance states of a single-molecule junction

Journal of Physics Condensed Matter
2012 | Journal article
DOI: 10.1088/0953-8984/24/39/394012
EID:

2-s2.0-84866235341
Contributors: Wang, Y.F.; Néel, N.; Kröger, J.; Vázquez, H.; Brandbyge, M.; Wang, B.; Berndt, R.
Source: Self-asserted source
Héctor Vázquez via Scopus - Elsevier

Highly conducting π-conjugated molecular junctions covalently bonded to gold electrodes

Journal of the American Chemical Society
2011 | Journal article
DOI: 10.1021/ja208020j
EID:

2-s2.0-80054981867
Contributors: Chen, W.; Widawsky, J.R.; Vázquez, H.; Schneebeli, S.T.; Hybertsen, M.S.; Breslow, R.; Venkataraman, L.
Source: Self-asserted source
Héctor Vázquez via Scopus - Elsevier
grade
Preferred source (of 2)‎

In situ formation of highly conducting covalent Au-C contacts for single-molecule junctions

Nature Nanotechnology
2011 | Journal article
DOI: 10.1038/nnano.2011.66
EID:

2-s2.0-79960125421
Contributors: Cheng, Z.-L.; Skouta, R.; Vazquez, H.; Widawsky, J.R.; Schneebeli, S.; Chen, W.; Hybertsen, M.S.; Breslow, R.; Venkataraman, L.
Source: Self-asserted source
Héctor Vázquez via Scopus - Elsevier

Atomic-scale control of electron transport through single molecules

Physical Review Letters
2010 | Journal article
DOI: 10.1103/PhysRevLett.104.176802
EID:

2-s2.0-77951550074
Contributors: Wang, Y.F.; Kröger, J.; Berndt, R.; Vázquez, H.; Brandbyge, M.; Paulsson, M.
Source: Self-asserted source
Héctor Vázquez via Scopus - Elsevier

Reliable formation of single molecule junctions with air-stable diphenylphosphine linkers

Journal of Physical Chemistry Letters
2010 | Journal article
DOI: 10.1021/jz100656s
EID:

2-s2.0-77954728877
Contributors: Parameswaran, R.; Widawsky, J.R.; Vázquez, H.; Park, Y.S.; Boardman, B.M.; Nuckolls, C.; Steigerwald, M.L.; Hybertsen, M.S.; Venkataraman, L.
Source: Self-asserted source
Héctor Vázquez via Scopus - Elsevier

The electrical properties of biphenylenes

Organic Letters
2010 | Journal article
DOI: 10.1021/ol1017036
EID:

2-s2.0-77956569349
Contributors: Schneebeli, S.; Kamenetska, M.; Foss, F.; Vazquez, H.; Skouta, R.; Hybertsen, M.; Venkataraman, L.; Breslow, R.
Source: Self-asserted source
Héctor Vázquez via Scopus - Elsevier

Band Alignment in Organic Materials

Advances in Solid State Physics
2009 | Book chapter
DOI: 10.1007/978-3-540-85859-1_17
Part of ISBN: 978-3-540-85859-1
Source: Self-asserted source
Héctor Vázquez

Corrections to the density-functional theory electronic spectrum: Copper phthalocyanine

Applied Physics A: Materials Science and Processing
2009 | Journal article
DOI: 10.1007/s00339-008-5022-0
EID:

2-s2.0-60749096787
Contributors: Vázquez, H.; Jelínek, P.; Brandbyge, M.; Jauho, A.P.; Flores, F.
Source: Self-asserted source
Héctor Vázquez via Scopus - Elsevier

Modelling energy level alignment at organic interfaces and density functional theory

Physical Chemistry Chemical Physics
2009 | Journal article
DOI: 10.1039/b902492c
EID:

2-s2.0-70349852839
Contributors: Flores, F.; Ortega, J.; Vázquez, H.
Source: Self-asserted source
Héctor Vázquez via Scopus - Elsevier

Barrier formation at organic interfaces in a Cu(100)-benzenethiolate- pentacene heterostructure

Physical Review Letters
2008 | Journal article
DOI: 10.1103/PhysRevLett.100.027601
EID:

2-s2.0-38349127059
Contributors: Betti, M.G.; Kanjilal, A.; Mariani, C.; Vázquez, H.; Dappe, Y.J.; Ortega, J.; Flores, F.
Source: Self-asserted source
Héctor Vázquez via Scopus - Elsevier

A unified model for metal/organic interfaces: IDIS, 'pillow' effect and molecular permanent dipoles

Applied Surface Science
2007 | Journal article
DOI: 10.1016/j.apsusc.2007.07.047
EID:

2-s2.0-35148874281
Contributors: Vázquez, H.; Dappe, Y.J.; Ortega, J.; Flores, F.
Source: Self-asserted source
Héctor Vázquez via Scopus - Elsevier

Energy level alignment at metal/organic semiconductor interfaces: "Pillow" effect, induced density of interface states, and charge neutrality level

Journal of Chemical Physics
2007 | Journal article
DOI: 10.1063/1.2717165
EID:

2-s2.0-34247248247
Contributors: Vázquez, H.; Dappe, Y.J.; Ortega, J.; Flores, F.
Source: Self-asserted source
Héctor Vázquez via Scopus - Elsevier

Induced Density of States model for weakly-interacting organic semiconductor interfaces

Organic Electronics: physics, materials, applications
2007 | Journal article
DOI: 10.1016/j.orgel.2006.07.006
EID:

2-s2.0-33847726261
Contributors: Vázquez, H.; Flores, F.; Kahn, A.
Source: Self-asserted source
Héctor Vázquez via Scopus - Elsevier

Doping-induced realignment of molecular levels at organic-organic heterojunctions

Chemical Physics
2006 | Journal article
DOI: 10.1016/j.chemphys.2005.09.015
EID:

2-s2.0-33646912709
Contributors: Kahn, A.; Zhao, W.; Gao, W.; Vázquez, H.; Flores, F.
Source: Self-asserted source
Héctor Vázquez via Scopus - Elsevier

Spin dynamics in weakly and strongly interacting NiO nanoparticles

Journal of Physics Condensed Matter
2006 | Journal article
DOI: 10.1088/0953-8984/18/49/013
EID:

2-s2.0-33846090729
Contributors: Bahl, C.R.H.; Lefmann, K.; Kuhn, L.T.; Christensen, N.B.; Vázquez, H.; Mørup, S.
Source: Self-asserted source
Héctor Vázquez via Scopus - Elsevier

Energy level alignment at organic heterojunctions: Role of the charge neutrality level

Physical Review B - Condensed Matter and Materials Physics
2005 | Journal article
DOI: 10.1103/PhysRevB.71.041306
EID:

2-s2.0-15744366155
Contributors: Vázquez, H.; Gao, W.; Flores, F.; Kahn, A.
Source: Self-asserted source
Héctor Vázquez via Scopus - Elsevier
Items per page:
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Peer review (117 reviews for 25 publications/grants)

Review activity for ACS applied materials & interfaces. (2)
Review activity for Advanced materials. (2)
Review activity for Applied physics letters. (1)
Review activity for Electrochimica acta. (1)
Review activity for International journal of hydrogen energy. (1)
Review activity for Journal of computational electronics. (1)
Review activity for Journal of materials chemistry. (3)
Review activity for Journal of physical chemistry. (9)
Review activity for Journal of physics. (2)
Review activity for Journal of the American Chemical Society. (3)
Review activity for Nano letters. (2)
Review activity for Nanoscale advances. (1)
Review activity for Nanoscale. (2)
Review activity for Nanotechnology. (3)
Review activity for Nature chemistry. (1)
Review activity for Nature communications (1)
Review activity for Nature nanotechnology (1)
Review activity for Physica scripta. (2)
Review activity for Physical chemistry chemical physics. (60)
Review activity for Physical review letters. (3)
Review activity for Physical review. (7)
Review activity for Small. (2)
Review activity for The journal of physical chemistry letters. (3)
Review activity for The journal of physical chemistry. (1)
Review activity for The journal of physical chemistry. (3)
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