Laalitha S I Liyanage

AFLOWπ: A minimalist approach to high-throughput ab initio calculations including the generation of tight-binding hamiltonians

D. Ceresoli, A. Calzolari, M. Nardelli, 2017, 1701.06921.

The AFLOW Fleet for Materials Discovery

Robert M. Hanson, Marco Buongiorno Nardelli, Cormac Toher, 2017, Handbook of Materials Modeling.

’ s Choice AFLOW p : A minimalist approach to high-throughput ab initio calculations including the generation of tight-binding hamiltonians

D. Ceresoli, A. Calzolari, M. Nardelli, 2017 .

Structural, elastic, and thermal properties of cementite ( Fe 3 C ) calculated using a modified embedded atom method

Mark F. Horstemeyer, Mark A. Tschopp, Sungho Kim, 2012, 1202.3068.

From Electrons to Atoms: Designing an Interatomic Potential for Fe-C Alloys

M. Baskes, M. Horstemeyer, Seong-Gon Kim, 2018 .