Skip to main content
Back to top
Ctrl
+
K
Search
Ctrl
+
K
User Guide
Overview
Quick-start
Tutorials
Installation guide
RSS workflow
Brief overview
Input YAML configuration file
Quick start
Examples
Phonon workflow
Out-of-the-box workflow
Generating reference data
Fitting phonon-accurate potentials
Benchmark of ML-based phonon structure
Executable tutorials
Iterative DFT vs MLIP benchmark workflow for phonons
RSS Workflow
Reference
API reference
autoplex.auto
autoplex.auto.phonons
autoplex.auto.phonons.flows
autoplex.auto.phonons.jobs
autoplex.auto.rss
autoplex.auto.rss.flows
autoplex.auto.rss.jobs
autoplex.benchmark
autoplex.benchmark.phonons
autoplex.benchmark.phonons.flows
autoplex.benchmark.phonons.jobs
autoplex.benchmark.phonons.utils
autoplex.benchmark.rss
autoplex.data
autoplex.data.common
autoplex.data.common.flows
autoplex.data.common.jobs
autoplex.data.common.utils
autoplex.data.phonons
autoplex.data.phonons.flows
autoplex.data.phonons.jobs
autoplex.data.phonons.utils
autoplex.data.rss
autoplex.data.rss.flows
autoplex.data.rss.jobs
autoplex.data.rss.utils
autoplex.fitting
autoplex.fitting.common
autoplex.fitting.common.flows
autoplex.fitting.common.jobs
autoplex.fitting.common.regularization
autoplex.fitting.common.utils
autoplex.fitting.phonons
autoplex.fitting.rss
autoplex.misc
autoplex.misc.castep
autoplex.misc.castep.flows
autoplex.misc.castep.jobs
autoplex.misc.castep.run
autoplex.misc.castep.schema
autoplex.misc.castep.utils
autoplex.misc.utils
autoplex.misc.utils.mock_castep
autoplex.settings
AutoplexBaseModel
AutoplexSettings
BcurParams
BuildcellOptions
CustomIncar
GAPGeneralSettings
GAPSettings
JACESettings
LossCoeff
M3GNETSettings
MACESettings
MLIPHypers
NEPSettings
NEQUIPSettings
Nonlinearity
ResumeFromPreviousState
RssConfig
SETTINGS
SoapParas
SoapSettings
ThreebSettings
TwobSettings
Contributing Guide
Contributing to autoplex
Developer Installation
About
Changelog
Contributors
License
Repository
Open issue
.rst
.pdf
autoplex.misc.castep.flows
autoplex.misc.castep.flows
#
CASTEP flows makers.
