Ludwig Ahrens-Iwers 49c84dbe1e Bugfix virial with fix electrode

2024-07-01 10:05:28 +02:00

..

.gitignore

Bugfix virial with fix electrode

2024-07-01 10:05:28 +02:00

data.au-elyt

Madelung benchmark

2022-10-12 07:01:44 +00:00

eval.py

Bugfix virial with fix electrode

2024-07-01 10:05:28 +02:00

in.cg

Madelung benchmark

2022-10-12 07:01:44 +00:00

in.eta

Simplify Madelung examples with mixed eta

2023-12-04 13:59:07 +01:00

in.eta_cg

Allow NULL for eta in fix electrode

2024-06-26 12:08:45 +02:00

in.eta_mix

Allow NULL for eta in fix electrode

2024-06-26 12:08:45 +02:00

in.ewald-ew2d

Madelung benchmark

2022-10-12 07:01:44 +00:00

in.ewald-ew3dc

Madelung benchmark

2022-10-12 07:01:44 +00:00

in.ewald-ffield

Madelung benchmark

2022-10-12 07:01:44 +00:00

in.pppm-ew3dc

Madelung benchmark

2022-10-12 07:01:44 +00:00

in.pppm-ffield

Madelung benchmark

2022-10-12 07:01:44 +00:00

log.1Dec2022.madelung-cg.g++.1

add madelung logs

2022-12-01 16:35:57 +10:00

log.1Dec2022.madelung-ewald-ew2d.g++.1

add madelung logs

2022-12-01 16:35:57 +10:00

log.1Dec2022.madelung-ewald-ew3dc.g++.1

add madelung logs

2022-12-01 16:35:57 +10:00

log.1Dec2022.madelung-ewald-ffield.g++.1

add madelung logs

2022-12-01 16:35:57 +10:00

log.1Dec2022.madelung-pppm-ew3dc.g++.1

add madelung logs

2022-12-01 16:35:57 +10:00

log.1Dec2022.madelung-pppm-ffield.g++.1

add madelung logs

2022-12-01 16:35:57 +10:00

log.19Feb2024.eta_cg.g++.1

Logs for eta mix example

2024-02-19 15:01:51 +01:00

log.19Feb2024.eta_mix.g++.1

Logs for eta mix example

2024-02-19 15:01:51 +01:00

log.19Feb2024.eta.g++.1

Logs for eta mix example

2024-02-19 15:01:51 +01:00

plate_cap.py

Bugfix virial with fix electrode

2024-07-01 10:05:28 +02:00

settings.mod

Bugfix virial with fix electrode

2024-07-01 10:05:28 +02:00

test.sh

Mix eta in Electrode package

2023-11-13 14:41:13 +01:00