Works (3)
Updated: July 5th, 2023 15:58
2006 journal article
Ab initio band bending, metal-induced gap states, and Schottky barriers of a carbon and a boron nitride nanotube device
PHYSICAL REVIEW B, 73(23).
Source: Web Of Science
Added: August 6, 2018
2004 journal article
Ab initio calculation of electrostatic multipoles with Wannier functions for large-scale biomolecular simulations
JOURNAL OF CHEMICAL PHYSICS, 120(9), 4530–4544.
MeSH headings : Algorithms; Biopolymers / chemistry; Computer Simulation; Electrochemistry / methods; Models, Chemical; Models, Molecular; Static Electricity
TL;DR:
Tests on isolated molecules and water dimers, show that the molecular electrostatic potentials generated by such a Wannier-function based approach are in excellent agreement with the density functional-based calculations.
(via Semantic Scholar)
UN Sustainable Development Goal Categories
3. Good Health and Well-being
(Web of Science)
Source: Web Of Science
Added: August 6, 2018
2004 journal article
Quantum transport through short semiconducting nanotubes: A complex band structure analysis
PHYSICAL REVIEW B, 70(11).
Source: Web Of Science
Added: August 6, 2018
Citation Index includes data from a number of different sources. If you have questions about the sources of data in the Citation Index or need a set of data which is free to re-distribute, please contact us.
Certain data included herein are derived from the Web of Science© and InCites© (2024) of Clarivate Analytics. All rights reserved. You may not copy or re-distribute this material in whole or in part without the prior written consent of Clarivate Analytics.
