Published 1991 | Version v1
Book

The electonic structure of grain boundaries in Nb

  • 1. Lawrence Livermore National Lab., CA (United States)
  • 2. Lawrence Berkeley Lab., CA (United States)

Description

This paper presents first principles calculations of the electronic structure of Nb grain boundaries. These are the first such calculations for a bcc metal using the real-space multiple-scattering theory (RSMST). Local densities of states near a Σ5 twist grain boundary are compared to those for bulk Nb

Additional details

Publishing Information

Publisher
Materials Research Society.
Imprint Place
Pittsburgh, PA (United States)
ISBN
1-55899-101-8
Imprint Title
Defects in materials
Imprint Pagination
909 p.
Journal Page Range
p. 131-133.

Conference

Title
Fall meeting of the Materials Research Society (MRS).
Dates
24 Nov - 1 Dec 1990.
Place
Boston, MA (United States).

INIS

Country of Publication
United States
Country of Input or Organization
United States
INIS RN
23041739
Subject category
S36: MATERIALS SCIENCE;
Resource subtype / Literary indicator
Conference
Descriptors DEI
BCC LATTICES; DENSITY MATRIX; ELECTRONIC STRUCTURE; GRAIN BOUNDARIES; METALS; MULTIPLE SCATTERING; NIOBIUM
Descriptors DEC
CRYSTAL LATTICES; CRYSTAL STRUCTURE; CUBIC LATTICES; ELEMENTS; MATRICES; MICROSTRUCTURE; SCATTERING; TRANSITION ELEMENTS

Optional Information

Secondary number(s)
CONF-901105--.