Works (8)

Updated: July 5th, 2023 16:00

2005 journal article

Self-consistent tight binding model adapted for hydrocarbon systems

MOLECULAR SIMULATION, 31(8), 585–595.

By: D. Areshkin*, O. Shenderova*, J. Schall* & D. Brenner*

author keywords: fitting eigenvalue spectra; fitting electron densities; DF-TB
Source: Web Of Science
Added: August 6, 2018

2004 journal article

A self-consistent tight binding model for hydrocarbon systems: application to quantum transport simulation

JOURNAL OF PHYSICS-CONDENSED MATTER, 16(39), 6851–6866.

By: D. Areshkin n, O. Shenderova n, J. Schall n, S. Adiga n & D. Brenner n

co-author countries: United States of America 🇺🇸
Source: Web Of Science
Added: August 6, 2018

2004 journal article

Electron emission properties of detonation nanodiamonds

PHYSICS OF THE SOLID STATE, 46(4), 657–661.

By: . Zhirnov n, O. Shenderova n, D. Jaeger n, T. Tyler n, D. Areshkin n, D. Brenner n, J. Hren n

co-author countries: United States of America 🇺🇸
Source: Web Of Science
Added: August 6, 2018

2004 journal article

Electronic properties of diamond clusters: self-consistent tight binding simulation

DIAMOND AND RELATED MATERIALS, 13(10), 1826–1833.

By: D. Areshkin n, O. Shenderova n, S. Adiga n & D. Brenner n

co-author countries: United States of America 🇺🇸
author keywords: diamond clusters; field emission; electron affinity
Source: Web Of Science
Added: August 6, 2018

2003 journal article

Bonding and stability of hybrid diamond/nanotube structures

MOLECULAR SIMULATION, 29(4), 259–268.

By: O. Shenderova n, D. Areshkin n & D. Brenner n

co-author countries: United States of America 🇺🇸
author keywords: hybrid structures; diamond; nanotube; bonding and stability
Source: Web Of Science
Added: August 6, 2018

2003 journal article

Convergence acceleration scheme for self-consistent orthogonal-basis-set electronic structure methods

MOLECULAR SIMULATION, 29(4), 269–286.

By: D. Areshkin n, O. Shenderova n, J. Schall n & D. Brenner n

co-author countries: United States of America 🇺🇸
author keywords: convergence acceleration scheme; Newton-Raphson algorithm; self-consistent orthogonal-basis-set electronic structure method; HOMO-LUMO gap
Source: Web Of Science
Added: August 6, 2018

2002 journal article

Atomic modeling of carbon-based nanostructures as a tool for developing new materials and technologies

Computer Modeling in Engineering & Sciences : CMES, 3(5), 643–673.

By: D. Brenner, O. Shenderova, D. Areshkin, J. Schall & S. Frankland

Source: NC State University Libraries
Added: August 6, 2018

2001 article

Predicted structure and electronic properties of individual carbon nanocones and nanostructures assembled from nanocones

Shenderova, O. A., Lawson, B. L., Areshkin, D., & Brenner, D. W. (2001, September). NANOTECHNOLOGY, Vol. 12, pp. 191–197.

By: O. Shenderova n, B. Lawson n, D. Areshkin n & D. Brenner n

co-author countries: United States of America 🇺🇸
Source: Web Of Science
Added: August 6, 2018

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