A first-principles study of cementite (Fe3C) and its alloyed counterparts: Elastic constants, elastic anisotropies, and isotropic elastic moduli

Genomic materials design: The ferrous frontier

(2013) G.B. Olson   ACTA MATERIALIA

ElaStic: A tool for calculating second-order elastic constants from first principles

(2013) Rostam Golesorkhtabar et al.   COMPUTER PHYSICS COMMUNICATIONS

Lattice instabilities in metallic elements

(2012) Göran Grimvall et al.   REVIEWS OF MODERN PHYSICS

CALPHAD, first and second generation – Birth of the materials genome

(2012) Larry Kaufman et al.   SCRIPTA MATERIALIA

Elasticity and anisotropy of Fe3C at high pressures

(2011) M. Mookherjee   AMERICAN MINERALOGIST

First-principles prediction of partitioning of alloying elements between cementite and ferrite

(2010) Chaitanya Krishna Ande et al.   ACTA MATERIALIA

Polycrystalline elastic constants of in situ cementite (Fe3C)

(2009) Hassel Ledbetter   MATERIALS SCIENCE AND ENGINEERING A-STRUCTURAL MATERIALS PROPERTIES MICROSTRUCTURE AND PROCESSING

First-principles calculations of the structural and thermodynamic properties of bcc, fcc and hcp solid solutions in the Al–TM (TM=Ti, Zr and Hf) systems: A comparison of cluster expansion and supercell methods

(2008) G. Ghosh et al.   ACTA MATERIALIA

First-principles study on the mechanical, electronic and magnetic properties of Fe3C

(2008) Z.Q. Lv et al.   COMPUTATIONAL MATERIALS SCIENCE

Substitutional solution of silicon in cementite: A first-principles study

(2008) Jae Hoon Jang et al.   COMPUTATIONAL MATERIALS SCIENCE

Structural, elastic, and electronic properties of Fe3C from first principles

(2008) C. Jiang et al.   JOURNAL OF APPLIED PHYSICS

Extreme elastic anisotropy of cementite, Fe3C: First-principles calculations and experimental evidence

(2008) M. Nikolussi et al.   SCRIPTA MATERIALIA