Commits · master · nomad-lab / soap-plus-plus

21 Sep, 2017 3 commits
- Harmonic net, TODO remove com motion. · 1e1f9ac2
  Carl Poelking authored Sep 21, 2017
  
  1e1f9ac2
- Merge https://gitlab.mpcdf.mpg.de/nomad-lab/soap-plus-plus · 81e2ec72
  Carl Poelking authored Sep 21, 2017
  
  81e2ec72
- PowerSpectrum wrapper, supporting descriptor maps. · 4bc8634d
  Carl Poelking authored Sep 21, 2017
  
  4bc8634d
14 Sep, 2017 4 commits
- Seeded subsampling. · 81ec4f49
  Carl Poelking authored Sep 14, 2017
  
  81ec4f49
- Network optimiser for dim-red. · 5f8a2b3c
  Carl Poelking authored Sep 14, 2017
  
  5f8a2b3c
- Backward compatibility fix. · d941ea9c
  Carl Poelking authored Sep 14, 2017
  
  d941ea9c
- Graph dMap support, DEBUG option. · ea6e13c7
  Carl Poelking authored Sep 14, 2017
  
  ea6e13c7
31 May, 2017 1 commit
- Symmetry considerations. · 560f13c7
  Carl Poelking authored May 31, 2017
  
  560f13c7
26 May, 2017 2 commits
- Some more 3j. · 87b4b393
  Carl Poelking authored May 26, 2017
  
  87b4b393
- FTD scale invariance and 3j. · b59ad85f
  Carl Poelking authored May 26, 2017
  
  b59ad85f
25 May, 2017 1 commit
- Wigner symbols (external). · 403dc4ac
  Carl Poelking authored May 25, 2017
  
  403dc4ac
22 May, 2017 2 commits
- Npy float to index fix. · e45c2a68
  Carl Poelking authored May 22, 2017
  
  e45c2a68
- mp_compute_graph interface, logging prefix. · 7c1d11fe
  Carl Poelking authored May 22, 2017
  
  7c1d11fe
17 May, 2017 1 commit
- Graph: forward integration. · 4e353a33
  Carl Poelking authored May 17, 2017
  
  4e353a33
05 May, 2017 1 commit
- Added linear reponse in atomic spectrum. · 8aa9e4b3
  Carl Poelking authored May 05, 2017
  
  8aa9e4b3
28 Apr, 2017 1 commit
- Some code cleaning. · 79662fd3
  Carl Poelking authored Apr 28, 2017
  
  79662fd3
12 Apr, 2017 1 commit
- xy vs z asymmetry fix. · c533d091
  Carl Poelking authored Apr 12, 2017
  
  c533d091
10 Apr, 2017 1 commit
- Relative import in partition.py · 4d33dbc1
  Carl Poelking authored Apr 10, 2017
  
  4d33dbc1
28 Mar, 2017 1 commit
- Deconstructionism. · 1d56428b
  Carl Poelking authored Mar 28, 2017
  
  1d56428b
27 Mar, 2017 3 commits
- Merge branch 'master' of https://github.com/capoe/soapxx · 61d6e95e
  Carl Poelking authored Mar 27, 2017
```
Merged in field-tensor descriptors.
```
  61d6e95e
- Gobbledygook. · af028a7e
  Carl Poelking authored Mar 27, 2017
  
  af028a7e
- Field tensor contractions. · 70376a5d
  Carl Poelking authored Mar 27, 2017
  
  70376a5d
20 Mar, 2017 4 commits
- Converging. · 8dc98121
  capoe authored Mar 20, 2017
  
  8dc98121
- Readme fix. · 407559e0
  capoe authored Mar 20, 2017
  
  407559e0
- Updated readme. · f3e1e666
  capoe authored Mar 20, 2017
  
  f3e1e666
- GLOG output. · 2abfb489
  Carl Poelking authored Mar 20, 2017
  
  2abfb489
27 Feb, 2017 2 commits
- Added atomic rematch kernel. · 5ec40e2e
  Carl Poelking authored Feb 27, 2017
  
  5ec40e2e
- Support for key-value descriptors. · bad7b67f
  Carl Poelking authored Feb 27, 2017
  
  bad7b67f
20 Feb, 2017 1 commit
- Extended cube-file output interface. · 12daccc3
  Carl Poelking authored Feb 20, 2017
  
  12daccc3
25 Dec, 2016 1 commit
- Tensor data structures. · 30eeab2e
  Carl Poelking authored Dec 25, 2016
  
  30eeab2e
20 Dec, 2016 1 commit
- Tlmlm framework. · a42be09a
  Carl Poelking authored Dec 20, 2016
  
  a42be09a
15 Dec, 2016 2 commits
- FT init. Special functions. · 9db375dc
  Carl Poelking authored Dec 15, 2016
  
  9db375dc
- Cluster integration. · ed537e96
  Carl Poelking authored Dec 15, 2016
  
  ed537e96
14 Dec, 2016 1 commit
- HierCoul descriptor. · bdae4286
  Carl Poelking authored Dec 14, 2016
  
  bdae4286
13 Dec, 2016 1 commit
- Cluster integration. · 65dcc1bd
  Carl Poelking authored Dec 13, 2016
  
  65dcc1bd
12 Dec, 2016 1 commit
- Kernel adaptor for esoap. · a403108e
  Carl Poelking authored Dec 12, 2016
  
  a403108e
09 Dec, 2016 1 commit
- Energy model spectrum, non-local contractions. · e9857d56
  Carl Poelking authored Dec 09, 2016
  
  e9857d56
11 Nov, 2016 1 commit
- Changes for cluster integration. · 3559fa16
  Carl Poelking authored Nov 11, 2016
  
  3559fa16
10 Nov, 2016 1 commit
- Utilities. · bb674c8c
  Carl Poelking authored Nov 10, 2016
  
  bb674c8c
03 Nov, 2016 1 commit
- Merge branch 'master' of https://github.com/capoe/soapxx · 926cd6dd
  Carl Poelking authored Nov 03, 2016
  
  926cd6dd