List of works - Vladimiro Mujica

A bioinspired redox relay that mimics radical interactions of the Tyr-His pairs of photosystem II.

scientific article

A nickel phosphine complex as a fast and efficient hydrogen production catalyst.

scientific article published on 16 January 2015

A simple theoretical model to study the voltage dependence of the electronic structure of phenyl ethylene oligomers.

scientific article published in December 2003

An Ideal Spin Filter: Long-Range, High-Spin Selectivity in Chiral Helicoidal 3-Dimensional Metal Organic Frameworks

scientific article published on 10 November 2020

CO2 Preactivation in Photoinduced Reduction via Surface Functionalization of TiO2 Nanoparticles

scientific article published on 22 January 2013

Carrier Transport Engineering in Carbon Nanotubes by Chirality-Induced Spin Polarization

scientific article published on 02 March 2020

Catalytic hydrogen evolution by Fe(II) carbonyls featuring a dithiolate and a chelating phosphine.

scientific article published on 11 August 2014

Chemically induced magnetism in atomically precise gold clusters

scientific article published on 22 October 2013

Chemisorption-induced spin symmetry breaking in gold clusters and the onset of paramagnetism in capped gold nanoparticles

scientific article published on 01 January 2006

Chemistry at molecular junctions: Rotation and dissociation of O2 on the Ag(110) surface induced by a scanning tunneling microscope

scientific article

Chiral electron transport: Scattering through helical potentials

scientific article published on 7 July 2009

Chiral molecular films as electron polarizers and polarization modulators

scientific article published in July 2012

Chiral-Induced Spin Selectivity: A Symmetry Analysis of Electronic Transmission

Chirality-Induced Electron Spin Polarization and Enantiospecific Response in Solid State Cross-Polarization Nuclear Magnetic Resonance

Coherence preservation and electron-phonon interaction in electron transfer in DNA

scientific article published on 01 October 2020

Continuum model for chiral induced spin selectivity in helical molecules. ⬇️

scientific article published in May 2015

Correlating Electron Transport and Molecular Structure in Organic Thin Films This work was supported by the Office of Naval Research, the Defense Advanced Research Project Agency, and the National Science Foundation ECS-97294053. R.E.H. thanks the N

scientific article published on 01 June 2001

Corrigendum: Intermediate tunnelling-hopping regime in DNA charge transport

scientific article published on 01 February 2017

Cotunneling model for current-induced events in molecular wires

scientific article published on 23 September 2008

Dipole orientation and surface cluster size effects on chemisorption-induced magnetism: a DFT study of the interaction of gold-thiopolypeptide

scientific article

Dynamics of charge transfer: rate processes formulated with nonequilibrium Green's functions.

scientific article published in April 2007

Effective spin-orbit couplings in an analytical tight-binding model of DNA: Spin filtering and chiral spin transport

scientific article published on 28 April 2016

Electrochemical Capture and Release of Carbon Dioxide Using a Disulfide-Thiocarbonate Redox Cycle.

scientific article published on 4 January 2017

Electronic Structure and Triplet-Triplet Energy Transfer in Artificial Photosynthetic Antennas

scientific article published on 11 August 2018

Enantiospecific Response in Cross-Polarization Solid-State Nuclear-Magnetic-Resonance of Optically Active Metal Organic Frameworks

scientific article published on 17 September 2020

Enhanced Magnetoresistance in Chiral Molecular Junctions

scientific article published on 10 September 2018

Exploring local currents in molecular junctions

scientific article published on 7 February 2010

Fano-Liouville spectral signatures in open quantum systems ⬇️

scientific article published in Physical Review Letters

Gate-controlled conductance switching in DNA.

scientific article published on 20 February 2017

Gated-Controlled Rectification of a Self-Assembled Monolayer-Based Transistor

scientific article published on 17 April 2013

Ghost transmission: How large basis sets can make electron transport calculations worse.

scientific article published in January 2010

Inelastic electron scattering from a helical potential: transverse polarization and the structure factor in the single scattering approximation.

scientific article published on 29 November 2013

Influence of Electronic Structure Modeling and Junction Structure on First-Principles Chiral Induced Spin Selectivity

scientific article published on 09 November 2020

Insight into the Origin of Chiral-Induced Spin Selectivity from a Symmetry Analysis of Electronic Transmission

scientific article published on 09 April 2020

Intermediate tunnelling-hopping regime in DNA charge transport.

scientific article published in March 2015

Intrinsic Rashba coupling due to hydrogen bonding in DNA

scientific article published on 01 September 2019

Kinetic Energy Dependence of Spin Filtering of Electrons Transmitted through Organized Layers of DNA

scientific article published on 18 July 2013

Laser-induced nonlinear response in photoassisted resonant electronic transport

scientific article

Liquid Thermoelectrics: Review of Recent And Limited New Data of Thermogalvanic Cell Experiments

scientific article (publication date: November 2013)

Measuring the Spin-Polarization Power of a Single Chiral Molecule.

scientific article published on 18 October 2016

Molecular rectification in a metal-insulator-metal junction based on self-assembled monolayers.

scientific article published in October 2002

Nano-plasmonics: Chirality transfer takes a jump

scientific article published on 01 July 2015

Non-exponential Length Dependence of Conductance in Iodide-Terminated Oligothiophene Single-Molecule Tunneling Junctions.

scientific article published on 22 December 2015

Nonlinear Fano interferences in open quantum systems: An exactly solvable model ⬇️

scientific article published on 16 June 2016

Nonlinear Optical Effects Induced by Nanoparticles in Symmetric Molecules

scientific article published on 15 November 2010

Photoinduced kinetics of SERS in bioinorganic hybrid systems. a case study: dopamine-TiO2.

scientific article published on 5 August 2010

Piezoresistivity in single DNA molecules.

scientific article

Polarizability as a Molecular Descriptor for Conductance in Organic Molecular Circuits

scientific article published on 3 November 2016

Probing Raman enhancement in a dopamine-Ti2O4 hybrid using stretched molecular geometries

scientific article published on 06 February 2014

Probing the Nature of Charge Transfer at Nano-Bio Interfaces: Peptides on Metal Oxide Nanoparticles

scientific article

Reply to "Comment on 'Chirality-Induced Electron Spin Polarization and Enantiospecific Response in Solid-State Cross-Polarization Nuclear Magnetic Resonance'"

scientific article published on 28 May 2019

SERS as a Probe of Charge-Transfer Pathways in Hybrid Dye/Molecule–Metal Oxide Complexes

scientific article published on 6 February 2014

SERS of semiconducting nanoparticles (TiO(2) hybrid composites).

scientific article

Simple and accurate correlation of experimental redox potentials and DFT-calculated HOMO/LUMO energies of polycyclic aromatic hydrocarbons

scientific article published on 9 December 2012

Single-Molecule Conductance through Hydrogen Bonds: The Role of Resonances.

scientific article published on 21 July 2016

Solvent Effects on the Dynamic Polarizability and Raman Response of Molecule-Metal Oxide Hybrid Clusters

scientific article published on 30 May 2016

Spatial modulation of light transmission through a single microcavity by coupling of photosynthetic complex excitations to surface plasmons.

scientific article published on 9 June 2015

Spin-orbit Coupling Modulation in DNA by Mechanical Deformations

scientific article published on 27 June 2018

Stability and Quenching of Plasmon Resonance Absorption in Magnetic Gold Nanoparticles

The Role of Exchange Interactions in the Magnetic Response and Inter-Molecular Recognition of Chiral Molecules

scientific article published on 04 August 2020

List of works by Vladimiro Mujica

A bioinspired redox relay that mimics radical interactions of the Tyr-His pairs of photosystem II.

A nickel phosphine complex as a fast and efficient hydrogen production catalyst.

A simple theoretical model to study the voltage dependence of the electronic structure of phenyl ethylene oligomers.

An Ideal Spin Filter: Long-Range, High-Spin Selectivity in Chiral Helicoidal 3-Dimensional Metal Organic Frameworks

CO2 Preactivation in Photoinduced Reduction via Surface Functionalization of TiO2 Nanoparticles

Carrier Transport Engineering in Carbon Nanotubes by Chirality-Induced Spin Polarization

Catalytic hydrogen evolution by Fe(II) carbonyls featuring a dithiolate and a chelating phosphine.

Chemically induced magnetism in atomically precise gold clusters

Chemisorption-induced spin symmetry breaking in gold clusters and the onset of paramagnetism in capped gold nanoparticles

Chemistry at molecular junctions: Rotation and dissociation of O2 on the Ag(110) surface induced by a scanning tunneling microscope

Chiral electron transport: Scattering through helical potentials

Chiral molecular films as electron polarizers and polarization modulators

Chiral-Induced Spin Selectivity: A Symmetry Analysis of Electronic Transmission

Chirality-Induced Electron Spin Polarization and Enantiospecific Response in Solid State Cross-Polarization Nuclear Magnetic Resonance

Coherence preservation and electron-phonon interaction in electron transfer in DNA

Continuum model for chiral induced spin selectivity in helical molecules. ⬇️

Correlating Electron Transport and Molecular Structure in Organic Thin Films This work was supported by the Office of Naval Research, the Defense Advanced Research Project Agency, and the National Science Foundation ECS-97294053. R.E.H. thanks the N

Corrigendum: Intermediate tunnelling-hopping regime in DNA charge transport

Cotunneling model for current-induced events in molecular wires

Dipole orientation and surface cluster size effects on chemisorption-induced magnetism: a DFT study of the interaction of gold-thiopolypeptide

Dynamics of charge transfer: rate processes formulated with nonequilibrium Green's functions.

Effective spin-orbit couplings in an analytical tight-binding model of DNA: Spin filtering and chiral spin transport

Electrochemical Capture and Release of Carbon Dioxide Using a Disulfide-Thiocarbonate Redox Cycle.

Electronic Structure and Triplet-Triplet Energy Transfer in Artificial Photosynthetic Antennas

Enantiospecific Response in Cross-Polarization Solid-State Nuclear-Magnetic-Resonance of Optically Active Metal Organic Frameworks

Enhanced Magnetoresistance in Chiral Molecular Junctions

Exploring local currents in molecular junctions

Fano-Liouville spectral signatures in open quantum systems ⬇️

Gate-controlled conductance switching in DNA.

Gated-Controlled Rectification of a Self-Assembled Monolayer-Based Transistor

Ghost transmission: How large basis sets can make electron transport calculations worse.

Inelastic electron scattering from a helical potential: transverse polarization and the structure factor in the single scattering approximation.

Influence of Electronic Structure Modeling and Junction Structure on First-Principles Chiral Induced Spin Selectivity

Insight into the Origin of Chiral-Induced Spin Selectivity from a Symmetry Analysis of Electronic Transmission

Intermediate tunnelling-hopping regime in DNA charge transport.

Intrinsic Rashba coupling due to hydrogen bonding in DNA

Kinetic Energy Dependence of Spin Filtering of Electrons Transmitted through Organized Layers of DNA

Laser-induced nonlinear response in photoassisted resonant electronic transport

Liquid Thermoelectrics: Review of Recent And Limited New Data of Thermogalvanic Cell Experiments

Measuring the Spin-Polarization Power of a Single Chiral Molecule.

Molecular rectification in a metal-insulator-metal junction based on self-assembled monolayers.

Nano-plasmonics: Chirality transfer takes a jump

Non-exponential Length Dependence of Conductance in Iodide-Terminated Oligothiophene Single-Molecule Tunneling Junctions.

Nonlinear Fano interferences in open quantum systems: An exactly solvable model ⬇️

Nonlinear Optical Effects Induced by Nanoparticles in Symmetric Molecules

Photoinduced kinetics of SERS in bioinorganic hybrid systems. a case study: dopamine-TiO2.

Piezoresistivity in single DNA molecules.

Polarizability as a Molecular Descriptor for Conductance in Organic Molecular Circuits

Probing Raman enhancement in a dopamine-Ti2O4 hybrid using stretched molecular geometries

Probing the Nature of Charge Transfer at Nano-Bio Interfaces: Peptides on Metal Oxide Nanoparticles

Reply to "Comment on 'Chirality-Induced Electron Spin Polarization and Enantiospecific Response in Solid-State Cross-Polarization Nuclear Magnetic Resonance'"

SERS as a Probe of Charge-Transfer Pathways in Hybrid Dye/Molecule–Metal Oxide Complexes

SERS of semiconducting nanoparticles (TiO(2) hybrid composites).

Simple and accurate correlation of experimental redox potentials and DFT-calculated HOMO/LUMO energies of polycyclic aromatic hydrocarbons

Single-Molecule Conductance through Hydrogen Bonds: The Role of Resonances.

Solvent Effects on the Dynamic Polarizability and Raman Response of Molecule-Metal Oxide Hybrid Clusters

Spatial modulation of light transmission through a single microcavity by coupling of photosynthetic complex excitations to surface plasmons.

Spin-orbit Coupling Modulation in DNA by Mechanical Deformations

Stability and Quenching of Plasmon Resonance Absorption in Magnetic Gold Nanoparticles

The Role of Exchange Interactions in the Magnetic Response and Inter-Molecular Recognition of Chiral Molecules

Thermal Decoherence and Disorder Effects on Chiral-Induced Spin Selectivity