lammps_parse_thermo
Extract thermodynamic time-series data from LAMMPS output files by parsing log or thermo.dat files, retrieving columns such as step, temperature, and energy.
Instructions
Parse LAMMPS thermodynamic output and return time-series data.
Reads a LAMMPS log file or thermo.dat file and extracts columns like Step, Temp, PotEng, TotEng, Press, etc.
Args: filepath: Path to the LAMMPS thermo output file.
Input Schema
| Name | Required | Description | Default |
|---|---|---|---|
| filepath | Yes |
Output Schema
| Name | Required | Description | Default |
|---|---|---|---|
| result | Yes |