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GOFEE Tutorial
Welcome to the GOFEE with DFTB+ tutorial
Installation
Python environment
DFTB+ installation
GOFEE Installation
Tutorial
Overview
DFTB+ calculation
H2O system
HB sheet system
HB sheet system - parallelized
GOFEE calculation
C6H6 system
C6H6 system - parallelized
C6H6 system - multirun
GOFEE with DFTB+ calculation
C6H6 system
HB sheet system
Ti5O10 system
Benchmark
Parallelization
repository
open issue
.md
.pdf
GOFEE with DFTB+ calculation
GOFEE with DFTB+ calculation
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