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density function theory

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Series: ASM Handbook
Volume: 22A
Publisher: ASM International
Published: 01 December 2009
DOI: 10.31399/asm.hb.v22a.a0005429
EISBN: 978-1-62708-196-2
...Selected acronyms appearing in this article Table 1 Selected acronyms appearing in this article Acronym Meaning APW Augmented plane wave CALPHAD CALculation of PHAse Diagram methods CP Car and Parrinello methods DFT Density functional theory E(ρ) Functional...
Series: ASM Handbook
Volume: 22A
Publisher: ASM International
Published: 01 December 2009
DOI: 10.31399/asm.hb.v22a.a0005435
EISBN: 978-1-62708-196-2
...Abstract Abstract This article assesses the evolution of martensite modeling in the changing materials engineering environment. It describes the physics of displacive transformations using Ginzburg-Landau theory, microstructure representation, dynamics and simulations, density functional theory...
Series: ASM Handbook
Volume: 22B
Publisher: ASM International
Published: 01 November 2010
DOI: 10.31399/asm.hb.v22b.a0005544
EISBN: 978-1-62708-197-9
... or availability, vendor, or website information. Readers are invited to recommend additions or changes to this compilation. Please send the information to MemberServiceCenter@asminternational.org, with the subject line “Attn Handbook Editor, V22B.” Electronic structure methods (density functional theory...
Book: Casting
Series: ASM Handbook
Volume: 15
Publisher: ASM International
Published: 01 December 2008
DOI: 10.31399/asm.hb.v15.a0005206
EISBN: 978-1-62708-187-0
.... The adjustable parameters of these functions are obtained from fitting experimental thermochemical data (enthalpies, chemical potentials, etc.), experimental phase diagram data, or predictions from first principles calculations that are based on density functional theory ( Ref 9 ). Phase diagrams for ternary...
Series: ASM Handbook
Volume: 20
Publisher: ASM International
Published: 01 January 1997
DOI: 10.31399/asm.hb.v20.a0002476
EISBN: 978-1-62708-194-8
... in structural applications. brittle materials ceramics density function theory fabrication graphites intermetallics tensile strength Weibull distribution BRITTLE MATERIALS (e.g., ceramics, intermetallics, and graphites) are increasingly being used in the fabrication of lightweight components...
Series: ASM Handbook
Volume: 7
Publisher: ASM International
Published: 30 September 2015
DOI: 10.31399/asm.hb.v07.a0006107
EISBN: 978-1-62708-175-7
..., single point BET, multipoint BET, Langmuir surface area, mesopore volume, micropore size distribution (using carbon dioxide), and micropore surface area. Data packages based on classical data reduction models as well as comprehensive density function theory are available from the instrument suppliers...
Series: ASM Handbook
Volume: 22B
Publisher: ASM International
Published: 01 November 2010
DOI: 10.31399/asm.hb.v22b.a0005509
EISBN: 978-1-62708-197-9
... the functions of density in the yield criterion) based on the results of the experiments and, if necessary, introduces additional parameters into the model There exist several different approaches to the mathematical description of powder densification and shrinkage. Most of them consider powder material...
Series: ASM Handbook
Volume: 4B
Publisher: ASM International
Published: 30 September 2014
DOI: 10.31399/asm.hb.v04b.a0005933
EISBN: 978-1-62708-166-5
... conductivity, viscosity, specific heat, density, and surface tension. It reviews wetting and boiling heat-transfer characteristics of nanofluids as quenchants and highlights the importance of using nanofluids as effective quench media for the hardening process during heat treatment. The article describes...
Series: ASM Handbook
Volume: 2
Publisher: ASM International
Published: 01 January 1990
DOI: 10.31399/asm.hb.v02.a0001