ALAMODE is designed for analyzing lattice anharmonicity and lattice thermal conductivity of solids. By using an external DFT package such as VASP and Quantum ESPRESSO, you can extract harmonic and anharmonic force constants straightforwardly with ALAMODE. Using the anharmonic force constants, you can also calculate lattice thermal conductivity from first principles.
Nov. 21, 2017: Released version 1.0.0 [Release note]
Jul. 14, 2016: Released version 0.9.8 [Release note]
Terumasa TADANO (@ttadano)
Having trouble with ALAMODE? Check out our documentation or contact support the author by email.