Code Monkey home page Code Monkey logo

Comments (1)

PhilippRue avatar PhilippRue commented on May 26, 2024

Here it is still included:

../aiida-kkr/docs/source/examples/kkr_bandstruc_example.py:kkrcalc.use_kpoints(kpts) # pass kpoints as input
../aiida-kkr/docs/source/examples/kkr_bandstruc_example.py:kkrcalc.use_parent_folder(kkr_calc_converged.out.remote_folder)
../aiida-kkr/docs/source/examples/kkr_bandstruc_example.py:kkrcalc.use_parameters(ParameterData(dict=qdos_params.get_dict()))
../aiida-kkr/docs/source/examples/kkrimp_dos_example.py:GF_host_doscalc.use_parameters(ParaNode)
../aiida-kkr/docs/source/examples/kkrimp_dos_example.py:GF_host_doscalc.use_parent_folder(kkr_converged_parent_folder)
../aiida-kkr/docs/source/examples/kkrimp_dos_example.py:GF_host_doscalc.use_impurity_info(GF_host_calc.inp.impurity_info)
../aiida-kkr/docs/source/examples/kkrimp_dos_example.py:kkrimp_doscalc.use_host_Greenfunction_folder(GF_host_doscalc.out.remote_folder)
../aiida-kkr/docs/source/examples/kkrimp_dos_example.py:kkrimp_doscalc.use_parent_calc_folder(kkrimp_calc_converge.out.remote_folder)
../aiida-kkr/docs/source/examples/kkrimp_dos_example.py:kkrimp_doscalc.use_parameters(ParaNode)
../aiida-kkr/docs/source/examples/kkr_short_example.py:voro_calc.use_structure(Cu)
../aiida-kkr/docs/source/examples/kkr_short_example.py:voro_calc.use_parameters(ParaNode)
../aiida-kkr/docs/source/examples/kkr_short_example.py:kkr_calc.use_parameters(ParaNode)
../aiida-kkr/docs/source/examples/kkr_short_example.py:kkr_calc.use_parent_folder(voronoi_calc_folder)
../aiida-kkr/docs/source/examples/kkr_short_example.py:kkr_calc_continued.use_code(code)
../aiida-kkr/docs/source/examples/kkr_short_example.py:kkr_calc_continued.use_parameters(ParaNode)
../aiida-kkr/docs/source/examples/kkr_short_example.py:kkr_calc_continued.use_parent_folder(kkr_calc_parent_folder)
../aiida-kkr/docs/source/examples/kkr_short_example.py:GF_host_calc.use_parameters(ParaNode)
../aiida-kkr/docs/source/examples/kkr_short_example.py:GF_host_calc.use_parent_folder(kkr_converged_parent_folder)
../aiida-kkr/docs/source/examples/kkr_short_example.py:GF_host_calc.use_impurity_info(imp_info)
../aiida-kkr/docs/source/examples/kkr_short_example.py:voro_calc_aux.use_structure(new_struc)
../aiida-kkr/docs/source/examples/kkr_short_example.py:voro_calc_aux.use_parameters(kkrcalc_converged.inp.parameters)
../aiida-kkr/docs/source/examples/kkr_short_example.py:kkrimp_calc.use_code(kkrimp_code)
../aiida-kkr/docs/source/examples/kkr_short_example.py:kkrimp_calc.use_host_Greenfunction_folder(GF_host_output_folder)
../aiida-kkr/docs/source/examples/kkr_short_example.py:kkrimp_calc.use_impurity_potential(startpot_Au_imp_sfd)
../aiida-kkr/docs/source/examples/kkr_short_example.py:kkrimp_calc.use_parameters(ParamsKKRimp)
../aiida-kkr/docs/source/examples/kkr_short_example.py:kkrimp_calc_converge.use_parent_calc_folder(kkrimp_calc.out.remote_folder)
../aiida-kkr/docs/source/examples/kkr_short_example.py:kkrimp_calc_converge.use_host_Greenfunction_folder(kkrimp_calc.inp.GFhost_folder)
../aiida-kkr/docs/source/examples/kkr_short_example.py:kkrimp_calc_converge.use_parameters(ParamsKKRimp)
../aiida-kkr/docs/source/user_guide/workflows.rst:    * ``options`` (*ParameterData*, optional): Some settings for the computer you want to use (e.g. `queue_name`, `use_mpi`, `resources`, ...)
../aiida-kkr/docs/source/user_guide/workflows.rst:    * ``options`` (*ParameterData*, optional): Some settings for the computer you want to use (e.g. `queue_name`, `use_mpi`, `resources`, ...)
../aiida-kkr/docs/source/user_guide/workflows.rst:        * ``use_mpi`` (*bool*): 
../aiida-kkr/docs/source/user_guide/workflows.rst:     'use_mpi': False, 'nsteps': 50, 'resources': {'num_machines': 1}, 'delta_e_min': 1.0, 
../aiida-kkr/docs/source/user_guide/workflows.rst:    options = ParameterData(dict={'use_mpi':'false', 'queue_name':'viti_node', 'walltime_sec' : 60*60*2,  
../aiida-kkr/docs/source/user_guide/workflows.rst:    options = ParameterData(dict={'use_mpi':'false', 'queue_name':'viti_node', 'walltime_sec' : 60*60*2,  
../aiida-kkr/docs/source/user_guide/workflows.rst:    options = ParameterData(dict={'use_mpi': False, 'walltime_sec' : 60*60*2,  
../aiida-kkr/docs/source/user_guide/workflows.rst:    options = ParameterData(dict={'use_mpi': False, 'walltime_sec' : 60*60*2,  
../aiida-kkr/docs/source/user_guide/calculations.rst:          ``missing_params = params.get_missing_keys(use_aiida=True)``
../aiida-kkr/docs/source/user_guide/calculations.rst:    calc1.use_code(code)
../aiida-kkr/docs/source/user_guide/calculations.rst:    voro_calc.use_structure(Cu)
../aiida-kkr/docs/source/user_guide/calculations.rst:    voro_calc.use_parameters(ParaNode)
../aiida-kkr/docs/source/user_guide/calculations.rst:    kkr_calc.use_parameters(ParaNode)
../aiida-kkr/docs/source/user_guide/calculations.rst:    kkr_calc.use_parent_folder(voronoi_calc_folder)
../aiida-kkr/docs/source/user_guide/calculations.rst:    kkr_calc_continued.use_code(code)
../aiida-kkr/docs/source/user_guide/calculations.rst:    kkr_calc_continued.use_parameters(ParaNode)
../aiida-kkr/docs/source/user_guide/calculations.rst:    kkr_calc_continued.use_parent_folder(kkr_calc_parent_folder)
../aiida-kkr/docs/source/user_guide/calculations.rst:    GF_host_calc.use_parameters(ParaNode)
../aiida-kkr/docs/source/user_guide/calculations.rst:    GF_host_calc.use_parent_folder(kkr_converged_parent_folder)
../aiida-kkr/docs/source/user_guide/calculations.rst:    GF_host_calc.use_impurity_info(imp_info)
../aiida-kkr/docs/source/user_guide/calculations.rst:    voro_calc_aux.use_structure(new_struc)
../aiida-kkr/docs/source/user_guide/calculations.rst:    voro_calc_aux.use_parameters(kkrcalc_converged.inputs.parameters)
../aiida-kkr/docs/source/user_guide/calculations.rst:    kkrimp_calc.use_code(kkrimp_code)
../aiida-kkr/docs/source/user_guide/calculations.rst:    kkrimp_calc.use_host_Greenfunction_folder(GF_host_output_folder)
../aiida-kkr/docs/source/user_guide/calculations.rst:    kkrimp_calc.use_impurity_potential(startpot_Au_imp_sfd)
../aiida-kkr/docs/source/user_guide/calculations.rst:    kkrimp_calc.use_parameters(ParamsKKRimp)
../aiida-kkr/docs/source/user_guide/calculations.rst:    kkrimp_calc_converge.use_parent_calc_folder(kkrimp_calc.out.remote_folder)
../aiida-kkr/docs/source/user_guide/calculations.rst:    kkrimp_calc_converge.use_host_Greenfunction_folder(kkrimp_calc.inputs.GFhost_folder)
../aiida-kkr/docs/source/user_guide/calculations.rst:    kkrimp_calc_converge.use_parameters(ParamsKKRimp)
../aiida-kkr/docs/source/user_guide/calculations.rst:    GF_host_doscalc.use_parameters(ParaNode)
../aiida-kkr/docs/source/user_guide/calculations.rst:    GF_host_doscalc.use_parent_folder(kkr_converged_parent_folder)
../aiida-kkr/docs/source/user_guide/calculations.rst:    GF_host_doscalc.use_impurity_info(GF_host_calc.inputs.impurity_info)
../aiida-kkr/docs/source/user_guide/calculations.rst:    kkrimp_doscalc.use_host_Greenfunction_folder(GF_host_doscalc.out.remote_folder)
../aiida-kkr/docs/source/user_guide/calculations.rst:    kkrimp_doscalc.use_parent_calc_folder(kkrimp_calc_converge.out.remote_folder)
../aiida-kkr/docs/source/user_guide/calculations.rst:    kkrimp_doscalc.use_parameters(ParaNode)
../aiida-kkr/docs/source/user_guide/calculations.rst:    kkrcalc.use_kpoints(kpts) # pass kpoints as input
../aiida-kkr/docs/source/user_guide/calculations.rst:    kkrcalc.use_parent_folder(kkr_calc_converged.out.remote_folder)
../aiida-kkr/docs/source/user_guide/calculations.rst:    kkrcalc.use_parameters(Dict(dict=qdos_params.get_dict()))

Should be replaced with process builder.

from aiida-kkr.

Related Issues (20)

Recommend Projects

  • React photo React

    A declarative, efficient, and flexible JavaScript library for building user interfaces.

  • Vue.js photo Vue.js

    🖖 Vue.js is a progressive, incrementally-adoptable JavaScript framework for building UI on the web.

  • Typescript photo Typescript

    TypeScript is a superset of JavaScript that compiles to clean JavaScript output.

  • TensorFlow photo TensorFlow

    An Open Source Machine Learning Framework for Everyone

  • Django photo Django

    The Web framework for perfectionists with deadlines.

  • D3 photo D3

    Bring data to life with SVG, Canvas and HTML. 📊📈🎉

Recommend Topics

  • javascript

    JavaScript (JS) is a lightweight interpreted programming language with first-class functions.

  • web

    Some thing interesting about web. New door for the world.

  • server

    A server is a program made to process requests and deliver data to clients.

  • Machine learning

    Machine learning is a way of modeling and interpreting data that allows a piece of software to respond intelligently.

  • Game

    Some thing interesting about game, make everyone happy.

Recommend Org

  • Facebook photo Facebook

    We are working to build community through open source technology. NB: members must have two-factor auth.

  • Microsoft photo Microsoft

    Open source projects and samples from Microsoft.

  • Google photo Google

    Google ❤️ Open Source for everyone.

  • D3 photo D3

    Data-Driven Documents codes.