First-principles study of point defects in an fcc Fe-10Ni-20Cr model alloy

Defect and solute properties in dilute Fe-Cr-Ni austenitic alloys from first principles

(2012) T. P. C. Klaver et al.   PHYSICAL REVIEW B

Equation of state of paramagnetic CrN fromab initiomolecular dynamics

(2012) Peter Steneteg et al.   PHYSICAL REVIEW B

Ab initiodescription of monovacancies in paramagnetic austenitic Fe-Cr-Ni alloys

(2012) L. Delczeg et al.   PHYSICAL REVIEW B

Atomic forces at finite magnetic temperatures: Phonons in paramagnetic iron

(2012) F. Körmann et al.   PHYSICAL REVIEW B

Waste-recycling Monte Carlo with optimal estimates: Application to free energy calculations in alloys

(2011) Gilles Adjanor et al.   JOURNAL OF CHEMICAL PHYSICS

Structural and magnetic ground-state properties ofγ-FeMn alloys fromab initiocalculations

(2011) M. Ekholm et al.   PHYSICAL REVIEW B

Ab initio calculations and interatomic potentials for iron and iron alloys: Achievements within the Perfect Project

(2010) L. Malerba et al.   JOURNAL OF NUCLEAR MATERIALS

Ab initio-based diffusion theory and tracer diffusion in Ni–Cr and Ni–Fe alloys

(2010) J.D. Tucker et al.   JOURNAL OF NUCLEAR MATERIALS

Effect of magnetic disorder and strong electron correlations on the thermodynamics of CrN

(2010) B. Alling et al.   PHYSICAL REVIEW B

Ab initiostudy of solute transition-metal interactions with point defects in bcc Fe

(2010) P. Olsson et al.   PHYSICAL REVIEW B

Magnetic and structural study of FCCγ-Fe precipitates in Cu

(2009) W. A. Hines et al.   PHYSICA STATUS SOLIDI B-BASIC SOLID STATE PHYSICS

Ab initiostudy of the phase stability in paramagnetic duplex steel alloys

(2009) H. Pitkänen et al.   PHYSICAL REVIEW B