Parameters in the compound energy formalism for ionic systems

Calphad ◽

10.1016/j.calphad.2008.05.006 ◽

2009 ◽

Vol 33 (1) ◽

pp. 227-232 ◽

Author(s):

M. Hillert ◽

L. Kjellqvist ◽

H. Mao ◽

M. Selleby ◽

B. Sundman

Keyword(s):

Compound Energy Formalism ◽

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Probing structural holes in disordered ionic systems

Il Nuovo Cimento D ◽

10.1007/bf03185462 ◽

1998 ◽

Vol 20 (9) ◽

pp. 1337-1344

Author(s):

G. Pastore ◽

H. Tatlipinar ◽

M. P. Tosi

Keyword(s):

Structural Holes ◽

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Representation of high-dimensional solid-liquid phase diagrams of ionic systems

AIChE Journal ◽

10.1002/aic.690470410 ◽

2001 ◽

Vol 47 (4) ◽

pp. 861-879 ◽

Author(s):

Ketan D. Samant ◽

Ka M. Ng

Keyword(s):

Liquid Phase ◽

Phase Diagrams ◽

High Dimensional ◽

Ionic Systems ◽

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Emulation of short-range ordering within the Compound Energy Formalism: Application to the calcite-magnesite solid solution

Calphad ◽

10.1016/j.calphad.2018.11.012 ◽

2019 ◽

Vol 64 ◽

pp. 115-125 ◽

Author(s):

Xin Liu ◽

Victor L. Vinograd ◽

Sergii Nichenko ◽

Dmitrii A. Kulik ◽

Xiancai Lu ◽

...

Keyword(s):

Solid Solution ◽

Short Range ◽

Compound Energy Formalism ◽

Short Range Ordering

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Structural effects in low temperature radioluminescence of aqueous ionic systems

Radiation Physics and Chemistry ◽

10.1016/s0969-806x(98)00305-3 ◽

1999 ◽

Vol 54 (6) ◽

pp. 567-574 ◽

Author(s):

Maria Wypych ◽

Jerzy Kroh

Keyword(s):

Low Temperature ◽

Structural Effects ◽

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Water transport in bi-ionic systems: theoretical treatment and effect on the bi-ionic potential

New Journal of Chemistry ◽

10.1039/a708758f ◽

1998 ◽

Vol 22 (6) ◽

pp. 605-608 ◽

Author(s):

Lasâad Dammak ◽

Roger Lteif ◽

Christian Larchet ◽

Bernard Auclair

Keyword(s):

Water Transport ◽

Theoretical Treatment ◽

Ionic Potential ◽

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OPTIMIZED CLUSTER THEORY FOR THE STRUCTURAL PROPERTIES OF MOLTEN IONIC SYSTEMS. MOLTEN PHASES OF AgI, Ag_{2}Se AND Ag_{2}S

Condensed Matter Physics ◽

10.5488/cmp.2.110 ◽

1993 ◽

pp. 110

Author(s):

Trokhymchuk ◽

Pizio

Keyword(s):

Structural Properties ◽

Cluster Theory ◽

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CALCULATION OF PHASE DIAGRAMS OF IONIC SYSTEMS FROM FUNDAMENTAL SOLUTION THEORIES∗

Chemical Engineering Communications ◽

10.1080/00986448108911002 ◽

1981 ◽

Vol 11 (6) ◽

pp. 327-334

Author(s):

M.-L. SABOUNG ◽

M. BLANDER

Keyword(s):

Fundamental Solution ◽

Phase Diagrams ◽

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Effects of periodic boundary conditions on simulations of ionic systems

Molecular Physics ◽

10.1080/00268978000102741 ◽

1980 ◽

Vol 41 (1) ◽

pp. 243-248 ◽

Author(s):

C.S. Hoskins ◽

E.R. Smith

Keyword(s):

Boundary Conditions ◽

Periodic Boundary ◽

Periodic Boundary Conditions ◽

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The Bragg-Williams-Gorsky (BWG) ordering treatment in the compound energy formalism (CEF)

Berichte der Bunsengesellschaft für physikalische Chemie ◽

10.1002/bbpc.19981020907 ◽

1998 ◽

Vol 102 (9) ◽

pp. 1102-1110 ◽

Author(s):

Suzana G. Fries ◽

Hans Leo Lukas ◽

Ibrahim Ansara ◽

Bo Sundman

Keyword(s):

Compound Energy Formalism

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Computing induced charges in inhomogeneous dielectric media: Application in a Monte Carlo simulation of complex ionic systems

Physical Review E ◽

10.1103/physreve.69.046702 ◽

2004 ◽

Vol 69 (4) ◽

Author(s):

Dezsö Boda ◽

Dirk Gillespie ◽

Wolfgang Nonner ◽

Douglas Henderson ◽

Bob Eisenberg

Keyword(s):

Monte Carlo Simulation ◽

Monte Carlo ◽

Dielectric Media ◽

Ionic Systems ◽

Inhomogeneous Dielectric

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