skip to main content
OSTI.GOV title logo U.S. Department of Energy
Office of Scientific and Technical Information

Title: Towards graphyne molecular electronics

Journal Article · · Nature Comm
DOI:https://doi.org/10.1038/ncomms7321· OSTI ID:1210746

Research Organization:
Energy Frontier Research Centers (EFRC) (United States). Center for the Computational Design of Functional Layered Materials (CCDM)
Sponsoring Organization:
USDOE Office of Science (SC), Basic Energy Sciences (BES)
DOE Contract Number:
SC0012575
OSTI ID:
1210746
Journal Information:
Nature Comm, Vol. 6; Related Information: CCDM partners with Temple University (lead); Brookhaven National Laboratory; Drexel University; Duke University; North Carolina State University; Northeastern University; Princeton University; Rice University; University of Pennsylvania
Country of Publication:
United States
Language:
English

References (55)

C60: Buckminsterfullerene journal November 1985
Helical microtubules of graphitic carbon journal November 1991
Electric Field Effect in Atomically Thin Carbon Films journal October 2004
Competition for Graphene: Graphynes with Direction-Dependent Dirac Cones journal February 2012
Carbo -graphite: Structural, Mechanical, and Electronic Properties journal October 2013
The era of carbon allotropes journal October 2010
Structure‐property predictions for new planar forms of carbon: Layered phases containing s p 2 and s p atoms journal December 1987
“Carbomers”. I. A general concept of expanded molecules journal January 1995
Families of carbon nanotubes: Graphyne-based nanotubes journal July 2003
Total c arbo -Mer of Benzene, Its c arbo- Trannulene Form, and the Zigzag Nanotube Thereof journal August 2006
A computational prediction of total carbo-merization on single-walled carbon nanotubes journal April 2011
Structural and electronic properties of new α-graphyne-based carbon fullerenes journal September 2004
From Macrocyclic Oligo-acetylenes to Aromatic Ring Carbo -mers journal December 2006
Synthesis of the Butatriene C 4 Function: Methodology and Applications journal October 2011
Variation of aromaticity by twisting or expanding the ring content journal March 2010
Silicene: Compelling Experimental Evidence for Graphenelike Two-Dimensional Silicon journal April 2012
Graphene Analogues of Inorganic Layered Materials journal October 2013
Evolution of Graphene Molecules: Structural and Functional Complexity as Driving Forces behind Nanoscience journal June 2014
Electron Transport in Single Molecules: From Benzene to Graphene journal March 2009
Dependence of single-molecule junction conductance on molecular conformation journal August 2006
Highly π electron-rich macro-aromatics: bis(p-aminophenyl)-carbo-benzenes and their DBA acyclic references journal January 2012
From Hexaoxy-[6]Pericyclynes to Carbo -Cyclohexadienes, Carbo -Benzenes, and Dihydro- Carbo -Benzenes: Synthesis, Structure, and Chromophoric and Redox Properties journal February 2012
Determining Charge Transport Pathways through Single Porphyrin Molecules Using Scanning Tunneling Microscopy Break Junctions journal December 2011
Quasi-Ohmic Single Molecule Charge Transport through Highly Conjugated meso -to- meso Ethyne-Bridged Porphyrin Wires journal May 2012
Measurement of Single-Molecule Resistance by Repeated Formation of Molecular Junctions journal August 2003
Single-Molecule Sensing of Environmental pH-an STM Break Junction and NEGF-DFT Approach journal December 2013
Electron Transport in Molecular Wire Junctions journal May 2003
Gate-controlled electron transport in coronenes as a bottom-up approach towards graphene transistors journal June 2010
Ab initio modeling of quantum transport properties of molecular electronic devices journal June 2001
Nonlinear Spin Current and Magnetoresistance of Molecular Tunnel Junctions journal April 2006
Effect of Anchoring Groups on Single Molecule Charge Transport through Porphyrins journal July 2013
Hapticity-Dependent Charge Transport through Carbodithioate-Terminated [5,15-Bis(phenylethynyl)porphinato]zinc(II) Complexes in Metal–Molecule–Metal Junctions journal September 2014
Molecular Electronics book January 2010
Generalized many-channel conductance formula with application to small rings journal May 1985
The Zero-Voltage Conductance of Nanographenes: Simple Rules and Quantitative Estimates journal April 2013
Single-Molecule Junctions Based on Nitrile-Terminated Biphenyls: A Promising New Anchoring Group journal January 2011
Redox State Dependence of Single Molecule Conductivity journal December 2003
Large Gate Modulation in the Current of a Room Temperature Single Molecule Transistor journal February 2005
Regulating a Benzodifuran Single Molecule Redox Switch via Electrochemical Gating and Optimization of Molecule/Electrode Coupling journal June 2014
Electron transport in molecular junctions journal December 2006
Single-Molecule Electrochemical Gating in Ionic Liquids journal September 2012
Synthesis and stereochemical resolution of a [6]pericyclynedione: Versatile access to pericyclynediol precursors of carbo-benzenes journal March 2009
Orientation-Controlled Single-Molecule Junctions journal July 2014
Ab initiomolecular dynamics for liquid metals journal January 1993
Efficient iterative schemes for ab initio total-energy calculations using a plane-wave basis set journal October 1996
Projector augmented-wave method journal December 1994
Generalized Gradient Approximation Made Simple journal October 1996
Efficient pseudopotentials for plane-wave calculations journal January 1991
Observation of quantum interference in molecular charge transport journal March 2012
Length Dependence of Conductance in Aromatic Single-Molecule Junctions journal November 2009
Study of the Structural and Electronic Properties of Rh N and Ru N Clusters ( N < 20) within the Density Functional Theory journal December 2009
On the hydrogen addition to graphene journal August 2009
The structure and properties of small Pd clusters journal April 2008
Oxygen neutral defects in silica: Origin of the distribution of the formation energies journal June 2004
Formation and Evolution of Single-Molecule Junctions journal March 2009