Publication in Faraday Discussions theme issue "Complex Molecular Surfaces and Interfaces" (24-26 July 2017, Sheffield, UK) Supramolecular systems at liquid-solid interfaces: general discussionįaraday Disc. Preparing macromolecular systems on surfaces: general discussionįaraday Disc. Work Function and Temperature Dependence of Electron Tunneling through an N-Type Perylene Diimide Molecular Junction with Isocyanide Surface Linkersįloppy Molecules as Candidates for Achieving Optoelectronic Molecular Devices without Skeletal Rearrangement or Bond Breaking Why One Can Expect Large Rectification in Molecular Junctions Based on Alkane Monothiols and Why Rectification Is So Modest Specific Issues Related to the Law of Corresponding States for the Charge Transport in Molecular Junctions Based on Graphene ElectrodesĪ novel route to get functionality in nanoelectronics: controlling the charge transport by the subtle impact of the coverage of self-assembled monolayers on the conformation of floppy molecules adsorbed on metallic electrodesĪ Sui Generis Electrode-Driven Spatial Confinement Effect Responsible for Strong Twisting Enhancement of Floppy Molecules in Closely Packed Self-Assembled Monolayers Mechanical Deformation Distinguishes Tunneling Pathways in Molecular Junctions
Included in the Virtual Issue Astrochemistry: From the Chemical Laboratory to the Starsĭetermination of Energy Level Alignment in Molecular Tunnel Junctions by Transport and Spectroscopy: Self-Consistency for the Case of Oligophenylene Thiols and Dithiols on Ag, Au, and Pt Electrodes Why Is This Important for Astrochemistry? Long Carbon-Based Chains of Interstellar Medium Can Have a Triplet Ground State. Impact of molecular conformation on transport and transport-related properties at the nanoscale Monthly Notices of the Royal Astronomical Society 493 (2020) 2506Įxtensive Quantum Chemistry Study of Neutral and Charged C 4N Chains: An Attempt to Aid Astronomical ObservationsĮvidence that Molecules in Molecular Junctions May not Be Subject to the Entire External Perturbation Applied to ElectrodesĮnergy Level Alignment in Molecular Tunnel Junctions by Transport and Spectroscopy: Self-Consistency for the Case of Alkyl Thiols and Dithiols on Ag, Au, and Pt Electrodes Profiling C 4N Radicals of Astrophysical Interest Monthly Notices of the Royal Astronomical Society 498 (2020) 4316 An Attempt to Aid Astronomical Observations Profiling Astrophysically Relevant MgC 4H chains. Suppression of Groups Intermingling as Appealing Option For Flattening and Delaying the Epidemiologic Curve While Allowing Economic and Social Life at Bearable Level During COVID-19 PandemicĪdvanced Theory and Simulations 3 (2020) 2000132 (Open access) Self-assembled monolayers of oligophenylenes stiffer than steel and silicon, possibly even stiffer than Si 3N 4Ĭorrection to Extensive Quantum Chemistry Study of Neutral and Charged C 4N Chains: An Attempt to Aid Astronomical Observations What Can We Learn from the Time Evolution of COVID-19 Epidemic in Slovenia?Īdvanced Theory and Simulations 4(7), 2000225 (2021) (Open access) Why asymmetric molecular coupling to electrodes cannot be at work in real molecular rectifiers Quantitative Analysis of Weak Current Rectification in Molecular Tunnel Junctions Subject to Mechanical Deformation Reveals Two Different Rectification Mechanisms for Oligophenylene Thiols versus Alkane Thiols Results of an Extensive Theoretical Study DOI: 10.1002/adts.202200077 (2022) 202200077 (Open access )Īlternation of Singlet and Triplet States in Carbon-Based Chain Molecules and Its Astrochemical Implications. DOI: 10.1002/adts.202200158 (2022) adts.202200158 (Open access )Īre Asymmetric SAM-Induced Work Function Modifications Relevant for Real Molecular Rectifiers?Īdv. Within a Single-Step Tunneling Mechanism in Molecular Junctions Subject to Mechanical StretchingĪdv. HC nH - Anion Chains with n \leq 8 are Nonlinear and Their Permanent Dipole Makes Them Potential Candidates for Astronomical ObservationĮxact Analytic Formula for Conductance Predicting a Tunable Sommerfeld-Arrhenius Thermal Transition An Attempt to Aid Astronomical ObservationsĪdv. (Recent publications list also - more or less regularly - updated atĬomprehensive Quantum Chemical Characterization of the Astrochemically Relevant HC nH Chain Family.
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