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Bonny, G., Pasianot, R.C., Zhurkin, E.E., Hou, M. (2011) Determination of the phase diagram from interatomic potentials: The iron–chromium case. Computational Materials Science, 50 (7). 2216-2220 doi:10.1016/j.commatsci.2011.02.032

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Reference TypeJournal (article/letter/editorial)
TitleDetermination of the phase diagram from interatomic potentials: The iron–chromium case
JournalComputational Materials Science
AuthorsBonny, G.Author
Pasianot, R.C.Author
Zhurkin, E.E.Author
Hou, M.Author
Year2011 (May)Volume50
Issue7
PublisherElsevier BV
DOIdoi:10.1016/j.commatsci.2011.02.032Search in ResearchGate
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Mindat Ref. ID9506572Long-form Identifiermindat:1:5:9506572:4
GUID0
Full ReferenceBonny, G., Pasianot, R.C., Zhurkin, E.E., Hou, M. (2011) Determination of the phase diagram from interatomic potentials: The iron–chromium case. Computational Materials Science, 50 (7). 2216-2220 doi:10.1016/j.commatsci.2011.02.032
Plain TextBonny, G., Pasianot, R.C., Zhurkin, E.E., Hou, M. (2011) Determination of the phase diagram from interatomic potentials: The iron–chromium case. Computational Materials Science, 50 (7). 2216-2220 doi:10.1016/j.commatsci.2011.02.032
In(2011, May) Computational Materials Science Vol. 50 (7) Elsevier BV

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Bonny, G., Pasianot, R.C., Malerba, L. (2009) Interatomic potentials for alloys: Fitting concentration dependent properties. Philosophical Magazine, 89 (8). 711-725 doi:10.1080/14786430902720994
Bonny, G., Pasianot, R.C., Terentyev, D., Malerba, L. (2011) Iron chromium potential to model high-chromium ferritic alloys. Philosophical Magazine, 91 (12). 1724-1746 doi:10.1080/14786435.2010.545780
Terentyev, D., Zhurkin, E.E., Bonny, G. (2012) Emission of full and partial dislocations from a crack in BCC and FCC metals: An atomistic study. Computational Materials Science, 55. 313-321 doi:10.1016/j.commatsci.2011.11.010
Bonny, G., Pasianot, R.C., Malerba, L. (2009) Fitting interatomic potentials consistent with thermodynamics: Fe, Cu, Ni and their alloys. Philosophical Magazine, 89 (34). 3451-3464 doi:10.1080/14786430903299337
Bonny, G., Bakaev, A., Olsson, P., Domain, C., Zhurkin, E.E., Posselt, M. (2017) Interatomic potential to study the formation of NiCr clusters in high Cr ferritic steels. Journal of Nuclear Materials, 484. 42-50 doi:10.1016/j.jnucmat.2016.11.017
Malerba, L., Ackland, G.J., Becquart, C.S., Bonny, G., Domain, C., Dudarev, S.L., Fu, C.-C., Hepburn, D., Marinica, M.C., Olsson, P., Pasianot, R.C., Raulot, J.M., Soisson, F., Terentyev, D., Vincent, E., Willaime, F. (2010) Ab initio calculations and interatomic potentials for iron and iron alloys: Achievements within the Perfect Project. Journal of Nuclear Materials, 406 (1). 7-18 doi:10.1016/j.jnucmat.2010.05.016
Bonny, G., Pasianot, R.C., Malerba, L., Caro, A., Olsson, P., Lavrentiev, M.Yu. (2009) Numerical prediction of thermodynamic properties of iron–chromium alloys using semi-empirical cohesive models: The state of the art. Journal of Nuclear Materials, 385 (2). 268-277 doi:10.1016/j.jnucmat.2008.12.001
Pasianot, R.C., Malerba, L. (2007) Interatomic potentials consistent with thermodynamics: The Fe–Cu system. Journal of Nuclear Materials, 360 (2). 118-127 doi:10.1016/j.jnucmat.2006.09.008
Bonny, G., Bakaev, A., Terentyev, D. (2022) The combined effect of carbon and chromium enrichment on 〈1 0 0〉 loop absorption in iron. Computational Materials Science, 211. 111533 doi:10.1016/j.commatsci.2022.111533
Daw, Murray S., Lawson, John W., Bauschlicher, Charles W. (2011) Interatomic potentials for Zirconium Diboride and Hafnium Diboride. Computational Materials Science, 50 (10). 2828-2835 doi:10.1016/j.commatsci.2011.04.038
Afify, N.D., Mountjoy, G., Haworth, R. (2017) Selecting reliable interatomic potentials for classical molecular dynamics simulations of glasses: The case of amorphous SiO2. Computational Materials Science, 128. 75-80 doi:10.1016/j.commatsci.2016.10.046
 
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