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Please use this identifier to cite or link to this item: http://dspace.bsu.edu.ru/handle/123456789/14037
Title: Formation energies of complexes of hydrogen and carbon atoms with vacancy in fcc aluminum from first-principles
Authors: Dat Vo Duy
Tam Do Due
Lipnitskii, A. G.
Keywords: technics
metal technology
metal science
first-principle calculations
aluminum
carbon-hvdrogen bond
impurity-vacancy complexes
formation energy
Issue Date: 2013
Citation: Dat Vo Duy. Formation energies of complexes of hydrogen and carbon atoms with vacancy in fcc aluminum from first-principles / Vo Duy Dat, A.G. Lipnitskii, Do Due Tam // Научные ведомости БелГУ. Сер. Математика. Физика. - 2013. - №26(169), вып.33.-С. 123-131. - Refer.: p. 130-131.
Series/Report no.: Математика. Физика;
Abstract: The DFT calculations are performed to investigate the interactions of hydrogen and carbon atoms with vacancy in fee aluminum. The solution energies of hydrogen and carbon atoms in aluminum, the cohesive energies of these atoms with vacancy and the formation energies of impurity-vacancy complexes were calculated
URI: http://dspace.bsu.edu.ru/handle/123456789/14037
Appears in Collections:Научные ведомости БелГУ. Сер. Математика. Физика

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