TY  - GEN
A1  - Grandel, Jonas
T1  - Harmonic phonon dataset
N2  - Phonon Dataset calculated with DFT PBE and the foundational MACE-MP-0b3 model.
The data are presented and discussed in the following publication: https://doi.org/10.1063/5.0297006
KW  - Phonon
KW  - MACE
KW  - DFT
PY  - 2025
UR  - https://github.com/ACEsuit/mace-foundations
PB  - GitHub
CY  - San Francisco, CA, USA
AN  - OPUS4-64747
LA  - eng
AD  - Bundesanstalt fuer Materialforschung und -pruefung (BAM), Berlin, Germany
ER  -