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lines changed Original file line number Diff line number Diff line change 1+ ---
2+ label : 2ppafm
3+ description : 2-point PPAFM code https://github.com/Probe-Particle/ppafm.git.
4+ input_plugin : nanotech_empa.afm
5+ on_computer : true
6+ remote_abs_path : /users/cpi/aiida-soft/2pp/run_2pp.sh
7+ prepend_text : |
8+ export PATH="/users/cpi/miniconda3/bin:$PATH"
9+ eval "$(conda shell.posix hook)"
10+ conda activate /users/cpi/miniconda3/envs/env-2ppafm
11+ append_text : ' '
Original file line number Diff line number Diff line change 1+ ---
2+ label : hrstm
3+ description : HRSTM code from https://github.com/nanotech-empa/cp2k-spm-tools.git
4+ input_plugin : nanotech_empa.hrstm
5+ on_computer : true
6+ remote_abs_path : /users/cpi/aiida-soft/cp2k-spm-tools/hrstm_from_wfn.py
7+ prepend_text : |
8+ export PATH="/users/cpi/miniconda3/bin:$PATH"
9+ eval "$(conda shell.posix hook)"
10+ conda activate /users/cpi/miniconda3/envs/env-stm
11+ append_text : ' '
Original file line number Diff line number Diff line change 1+ ---
2+ label : overlap
3+ description : Overlap code from https://github.com/nanotech-empa/cp2k-spm-tools.git.
4+ input_plugin : nanotech_empa.overlap
5+ on_computer : true
6+ remote_abs_path : /users/cpi/aiida-soft/cp2k-spm-tools/overlap_from_wfns.py
7+ prepend_text : |
8+ export PATH="/users/cpi/miniconda3/bin:$PATH"
9+ eval "$(conda shell.posix hook)"
10+ conda activate /users/cpi/miniconda3/envs/env-stm
11+ append_text : ' '
Original file line number Diff line number Diff line change 1+ ---
2+ label : ppafm
3+ description : PPAFM code https://github.com/Probe-Particle/ppafm.git.
4+ input_plugin : nanotech_empa.afm
5+ on_computer : true
6+ remote_abs_path : /users/cpi/aiida-soft/run_ppafm.sh
7+ prepend_text : |
8+ export PATH="/users/cpi/miniconda3/bin:$PATH"
9+ eval "$(conda shell.posix hook)"
10+ conda activate /users/cpi/miniconda3/envs/env-ppafm
11+ append_text : ' '
Original file line number Diff line number Diff line change 1+ ---
2+ label : stm
3+ description : STM from https://github.com/nanotech-empa/cp2k-spm-tools.git.
4+ input_plugin : nanotech_empa.stm
5+ on_computer : true
6+ remote_abs_path : /users/cpi/aiida-soft/cp2k-spm-tools/stm_sts_from_wfn.py
7+ prepend_text : |
8+ export PATH="/users/cpi/miniconda3/bin:$PATH"
9+ eval "$(conda shell.posix hook)"
10+ conda activate /users/cpi/miniconda3/envs/env-stm
11+ append_text : ' '
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