"Grain boundary magnetism - an ab initio study" . . . "Je studov\u00E1na segregace ne\u010Distot na hranic\u00EDch zrn v \u017Eeleze na z\u00E1klad\u011B v\u00FDpo\u010Dt\u016F elektronov\u00E9 struktury z prvn\u00EDch princip\u016F."@cs . "Grain boundary magnetism - an ab initio study" . "Grain boundaries (GBs) represent an important class of two-dimensional extended defects in materials. Segregation of impurity atoms is responsible for a degradation of mechanical properties. Recently, it was found that application of magnetic annealing leads to decreasing concentration of impurities at GBs in Fe-0.8%Sn alloy and improves its ductility To understand the mechanism of this process it is necessary to study magnetism of clean GBs as well as of GBs with segregants at the microscopic (ab initio) level. In the present work, we investigate the Sigma5(310) GB in iron."@en . "Grain boundary magnetism - an ab initio study"@en . "VII. pracovn\u00ED setk\u00E1n\u00ED fyzik\u00E1ln\u00EDch chemik\u016F a elektrochemik\u016F" . "423592" . "RIV/68081723:_____/07:00307352!RIV08-AV0-68081723" . "Grain boundaries (GBs) represent an important class of two-dimensional extended defects in materials. Segregation of impurity atoms is responsible for a degradation of mechanical properties. Recently, it was found that application of magnetic annealing leads to decreasing concentration of impurities at GBs in Fe-0.8%Sn alloy and improves its ductility To understand the mechanism of this process it is necessary to study magnetism of clean GBs as well as of GBs with segregants at the microscopic (ab initio) level. In the present work, we investigate the Sigma5(310) GB in iron." . . "\u010C\u00E1k, Miroslav" . "Masarykova univerzita" . . "2007-01-29+01:00"^^ . "2"^^ . . . "Brno" . . . "Studium magnetismu hranic zrn z prvn\u00EDch princip\u016F"@cs . "Brno" . "Studium magnetismu hranic zrn z prvn\u00EDch princip\u016F"@cs . . "Grain boundary magnetism - an ab initio study"@en . . . "grain boundaries; magnetism; ab initio calculations"@en . "2"^^ . "3"^^ . . . . "978-80-210-4235-3" . "[924A77878FD9]" . "P(GD106/05/H008), P(IAA1041302), P(OC 147), Z(AV0Z20410507)" . . . "RIV/68081723:_____/07:00307352" . . . . "\u0160ob, Mojm\u00EDr" . "23;24" . . . "Hafner, J." .