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DPGEN2
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User Guide
Guide on dpgen2 commands
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Guide on writing input scripts for dpgen2 commands
Arguments of the submit script
DPGEN2 configurations
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DPGEN2 API
dpgen2 package
DPGEN2
DPGEN2 API
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DPGEN2 API
dpgen2 package
Subpackages
dpgen2.conf package
Submodules
dpgen2.conf.alloy_conf module
dpgen2.conf.conf_generator module
dpgen2.conf.file_conf module
dpgen2.conf.unit_cells module
dpgen2.entrypoint package
Submodules
dpgen2.entrypoint.args module
dpgen2.entrypoint.common module
dpgen2.entrypoint.download module
dpgen2.entrypoint.main module
dpgen2.entrypoint.showkey module
dpgen2.entrypoint.status module
dpgen2.entrypoint.submit module
dpgen2.entrypoint.watch module
dpgen2.entrypoint.workflow module
dpgen2.exploration package
Subpackages
dpgen2.flow package
Submodules
dpgen2.flow.dpgen_loop module
dpgen2.fp package
Submodules
dpgen2.fp.gaussian module
dpgen2.fp.prep_fp module
dpgen2.fp.run_fp module
dpgen2.fp.vasp module
dpgen2.fp.vasp_input module
dpgen2.op package
Submodules
dpgen2.op.collect_data module
dpgen2.op.md_settings module
dpgen2.op.prep_dp_train module
dpgen2.op.prep_lmp module
dpgen2.op.run_dp_train module
dpgen2.op.run_lmp module
dpgen2.op.select_confs module
dpgen2.superop package
Submodules
dpgen2.superop.block module
dpgen2.superop.prep_run_dp_train module
dpgen2.superop.prep_run_fp module
dpgen2.superop.prep_run_lmp module
dpgen2.utils package
Submodules
dpgen2.utils.bohrium_config module
dpgen2.utils.chdir module
dpgen2.utils.dflow_config module
dpgen2.utils.dflow_query module
dpgen2.utils.download_dpgen2_artifacts module
dpgen2.utils.obj_artifact module
dpgen2.utils.run_command module
dpgen2.utils.step_config module
Submodules
dpgen2.constants module
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