List of works - Fritz Körmann

Ab initio assisted design of quinary dual-phase high-entropy alloys with transformation-induced plasticity

article by Zhiming Li et al published September 2017 in Acta Materialia

Ab initio thermodynamics of the CoCrFeMnNi high entropy alloy: Importance of entropy contributions beyond the configurational one

Accurate electronic free energies of the 3d,4d , and 5d transition metals at high temperatures

scholarly article in Physical Review B, vol. 95 no. 16, April 2017

Advancing density functional theory to finite temperatures: methods and applications in steel design

scientific article published on 09 December 2011

Anomalous Phonon Lifetime Shortening in Paramagnetic CrN Caused by Spin-Lattice Coupling: A Combined Spin and Ab Initio Molecular Dynamics Study

scientific article published in Physical Review Letters

Atomic forces at finite magnetic temperatures: Phonons in paramagnetic iron

scholarly article in Physical Review B, vol. 85 no. 12, March 2012

Atomistic Modeling-Based Design of Novel Materials

Combined Al and C alloying enables mechanism-oriented design of multi-principal element alloys: Ab initio calculations and experiments

scientific article published in March 2020

Computationally-driven engineering of sublattice ordering in a hexagonal AlHfScTiZr high entropy alloy

scientific article

Determining the Elasticity of Materials Employing Quantum-mechanical Approaches: From the Electronic Ground State to the Limits of Materials Stability

Free energy of bcc iron: Integratedab initioderivation of vibrational, electronic, and magnetic contributions

scholarly article in Physical Review B, vol. 78 no. 3, July 2008

Impact of Chemical Fluctuations on Stacking Fault Energies of CrCoNi and CrMnFeCoNi High Entropy Alloys from First Principles

scientific article published on 30 August 2018

Impact of Co and Fe Doping on the Martensitic Transformation and the Magnetic Properties in Ni-Mn-Based Heusler Alloys

article published in 2017

Influence of the dislocation core on the glide of the ½〈111〉{110} edge dislocation in bcc-iron: An embedded atom method study

Lattice Distortions in the FeCoNiCrMn High Entropy Alloy Studied by Theory and Experiment

Operando Phonon Studies of the Protonation Mechanism in Highly Active Hydrogen Evolution Reaction Pentlandite Catalysts.

scientific article

Partitioning of Cr and Si between cementite and ferrite derived from first-principles thermodynamics

Strong impact of lattice vibrations on electronic and magnetic properties of paramagnetic Fe revealed by disordered local moments molecular dynamics

scholarly article in Physical Review B, vol. 93 no. 22, June 2016

Structural stability and thermodynamics of CrN magnetic phases fromab initiocalculations and experiment

scholarly article in Physical Review B, vol. 90 no. 18, November 2014

Temperature Dependent Magnon-Phonon Coupling in bcc Fe from Theory and Experiment