Thermodynamic properties of MgO, Be, and W: A simplified computational approach

Y. Wang; R. Ahuja; B. Johansson

doi:10.1088/0953-8984/14/44/397

Thermodynamic properties of MgO, Be, and W: A simplified computational approach

Y. Wang, R. Ahuja, B. Johansson

Materials Science and Engineering

Research output: Contribution to journal › Article › peer-review

6 Scopus citations

Abstract

The recently developed classical mean-field potential (MFP) approach was employed to calculate the Helmholtz free energy for periclase (MgO), the Hugoniot equation of state for beryllium (Be) at pressures up to 2000 GPa, and the families of isentropic curves for tungsten (W). The excellent agreement between the theory and the experiment further demonstrated the high accuracy and applicability of the MFP approach.

Original language	English (US)
Pages (from-to)	10895-10900
Number of pages	6
Journal	Journal of Physics Condensed Matter
Volume	14
Issue number	44 SPEC ISS.
DOIs	https://doi.org/10.1088/0953-8984/14/44/397
State	Published - Nov 11 2002

All Science Journal Classification (ASJC) codes

General Materials Science
Condensed Matter Physics

Access to Document

10.1088/0953-8984/14/44/397

Cite this

@article{84f4e24009aa4ad78db9636cd0dbf2f0,

title = "Thermodynamic properties of MgO, Be, and W: A simplified computational approach",

abstract = "The recently developed classical mean-field potential (MFP) approach was employed to calculate the Helmholtz free energy for periclase (MgO), the Hugoniot equation of state for beryllium (Be) at pressures up to 2000 GPa, and the families of isentropic curves for tungsten (W). The excellent agreement between the theory and the experiment further demonstrated the high accuracy and applicability of the MFP approach.",

author = "Y. Wang and R. Ahuja and B. Johansson",

year = "2002",

month = nov,

day = "11",

doi = "10.1088/0953-8984/14/44/397",

language = "English (US)",

volume = "14",

pages = "10895--10900",

journal = "Journal of Physics Condensed Matter",

issn = "0953-8984",

publisher = "IOP Publishing Ltd.",

number = "44 SPEC ISS.",

}

TY - JOUR

T1 - Thermodynamic properties of MgO, Be, and W

T2 - A simplified computational approach

AU - Wang, Y.

AU - Ahuja, R.

AU - Johansson, B.

PY - 2002/11/11

Y1 - 2002/11/11

N2 - The recently developed classical mean-field potential (MFP) approach was employed to calculate the Helmholtz free energy for periclase (MgO), the Hugoniot equation of state for beryllium (Be) at pressures up to 2000 GPa, and the families of isentropic curves for tungsten (W). The excellent agreement between the theory and the experiment further demonstrated the high accuracy and applicability of the MFP approach.

AB - The recently developed classical mean-field potential (MFP) approach was employed to calculate the Helmholtz free energy for periclase (MgO), the Hugoniot equation of state for beryllium (Be) at pressures up to 2000 GPa, and the families of isentropic curves for tungsten (W). The excellent agreement between the theory and the experiment further demonstrated the high accuracy and applicability of the MFP approach.

UR - http://www.scopus.com/inward/record.url?scp=0037064959&partnerID=8YFLogxK

UR - http://www.scopus.com/inward/citedby.url?scp=0037064959&partnerID=8YFLogxK

U2 - 10.1088/0953-8984/14/44/397

DO - 10.1088/0953-8984/14/44/397

M3 - Article

AN - SCOPUS:0037064959

SN - 0953-8984

VL - 14

SP - 10895

EP - 10900

JO - Journal of Physics Condensed Matter

JF - Journal of Physics Condensed Matter

IS - 44 SPEC ISS.

ER -

Thermodynamic properties of MgO, Be, and W: A simplified computational approach

Abstract

All Science Journal Classification (ASJC) codes

Access to Document

Other files and links

Fingerprint

Cite this