Single Molecule Conductivity: The Role of Junction-Orbital Degeneracy in the Artificially High Currents Predicted by Ab Initio Approaches

Journal of Chemical Physics - United States
doi 10.1063/1.1791011
Full Text
Abstract

Available in full text

Date
Authors
Publisher

AIP Publishing

Related search

Ab Initio Investigation of Single-Layer High Thermal Conductivity Boron Compounds

Physical Review B
OpticalElectronicCondensed Matter PhysicsMagnetic Materials
2019English

Ab Initio Molecular Orbital Calculations of Model Compound Systems for the Water Molecule Sorbed Into Polymers.

Kobunshi Ronbunshu
Materials SciencePolymersPlasticsChemical EngineeringEnvironmental Science
1996English

Ab Initio Calculation of Lattice Thermal Conductivity

2018English

An Ab Initio Molecular Orbital Study of Lithiopyridines

Bulletin of the Chemical Society of Japan
Chemistry
1987English

High Spin Systems With Orbital Degeneracy

Physical Review Letters
AstronomyPhysics
2001English

On the Feasibility of Ab Initio Electronic Structure Calculations for Cu Using a Single S Orbital Basis

AIP Advances
NanotechnologyAstronomyPhysicsNanoscience
2015English

Ab Initio Green-Kubo Approach for the Thermal Conductivity of Solids

Physical Review Letters
AstronomyPhysics
2017English

Stereoelectronic Effects in Serine Proteases: Ab Initio Molecular Orbital Calculations

Bulletin of the Chemical Society of Japan
Chemistry
1987English

Molecular Orbital Approach to Antioxidant Mechanisms of Phenols by an Ab Initio Study

Bulletin of the Chemical Society of Japan
Chemistry
1991English

Amanote Research

Note-taking for researchers

Follow Amanote

© 2024 Amaplex Software S.P.R.L. All rights reserved.

Privacy PolicyRefund Policy