./Job.out_save output for 45: Energy of formation TMOS (re-do job_930)
Status: finished[Tue Nov 12 23:00:42 CST 2024] [MD] [warn] 'Starting MedeA Core 3.8.1' MedeA version 3.8.1 #------------------------------------------------------------------------------- # This calculation has 1 stage #------------------------------------------------------------------------------- Stage 1: VASP 6 #------------------------------------------------------------------------------- # Running the calculation #------------------------------------------------------------------------------- Stage 1: VASP 6 Sucessfully opened MedeA database from /home/user/MD/Databases/MedeA.db VASP 6 CALCULATION PROTOCOL: ============================ 1. Calculate reference energies of elements to obtain the formation energy (this requires several tasks, for protocol and results see Job_elements.out) 2. Geometry optimization (atom positions)