Commits · 7f900f6e5f84e892e8b28cfce695fb8640a11917 · fleur / fleur

23 Oct, 2019 7 commits
- Revert "make hybrid code more searchable" · 7f900f6e
  Matthias Redies authored Oct 23, 2019
```
This reverts commit c5b0637b.
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  7f900f6e
- make hybrid code more searchable · c5b0637b
  Matthias Redies authored Oct 23, 2019
  
  c5b0637b
- introduce init() & free() routines to prod · 57dee2b7
  Matthias Redies authored Oct 23, 2019
  
  57dee2b7
- remove useless comments · 9ae43782
  Matthias Redies authored Oct 23, 2019
  
  9ae43782
- replace array of type with type of array · b95ec6b1
  Matthias Redies authored Oct 23, 2019
  
  b95ec6b1
- Merge branch 'develop' into hybrid_purge · ac1c5cc0
  Matthias Redies authored Oct 23, 2019
  
  ac1c5cc0
- initialize gaunt · 6917a4f7
  Matthias Redies authored Oct 23, 2019
  
  6917a4f7
22 Oct, 2019 26 commits
- inpgen needs grule too · c1bcdf1e
  Matthias Redies authored Oct 22, 2019
  
  c1bcdf1e
- include judft · c92f3960
  Matthias Redies authored Oct 22, 2019
  
  c92f3960
- i renamed and tried to drop it · 827cd169
  Matthias Redies authored Oct 22, 2019
  
  827cd169
- close the bracket · 9fe93517
  Matthias Redies authored Oct 22, 2019
  
  9fe93517
- this call seems unnecessary · 37e2c084
  Matthias Redies authored Oct 22, 2019
  
  37e2c084
- use modern grule · 52b27c28
  Matthias Redies authored Oct 22, 2019
  
  52b27c28
- remove old-timey fortran and drop unused vars · 572f2051
  Matthias Redies authored Oct 22, 2019
  
  572f2051
- introduce dot_product in gaunt · 0b81bbdf
  Matthias Redies authored Oct 22, 2019
  
  0b81bbdf
- drop constant · dac508bd
  Matthias Redies authored Oct 22, 2019
  
  dac508bd
- use modern brackets · 7333732a
  Matthias Redies authored Oct 22, 2019
  
  7333732a
- Bugfix for hybrid functionals + LOs in hybrid/subvxc.F90 · 3009ecb0
  Gregor Michalicek authored Oct 22, 2019
```
The factors in the l=0 component of the vr array were wrong for LOs.
```
  3009ecb0
- rewrite with modern array notation · 0b8472ea
  Matthias Redies authored Oct 22, 2019
  
  0b8472ea
- keep reouting algo but disable it · f2c20054
  Matthias Redies authored Oct 22, 2019
  
  f2c20054
- remove rerouting algo for planewave · f0320722
  Matthias Redies authored Oct 22, 2019
  
  f0320722
- a little finishing touches for the format · 883536aa
  Matthias Redies authored Oct 22, 2019
  
  883536aa
- remove gregors debugging output · 45425021
  Matthias Redies authored Oct 22, 2019
  
  45425021
- rewrite last loop as matrix operation · 4727fda7
  Matthias Redies authored Oct 22, 2019
  
  4727fda7
- drop retarded j-variable · 2b45f1c5
  Matthias Redies authored Oct 22, 2019
  
  2b45f1c5
- use outer_prod in 2nd loop · 5863e3cb
  Matthias Redies authored Oct 22, 2019
  
  5863e3cb
- remove rdum & cdum form 2nd loop · 3ff6647b
  Matthias Redies authored Oct 22, 2019
  
  3ff6647b
- replace explicit outer product by routine · 2ef57f1f
  Matthias Redies authored Oct 22, 2019
  
  2ef57f1f
- drop cdum aswell · 7ed265a4
  Matthias Redies authored Oct 22, 2019
  
  7ed265a4
- drop rdum from first loop · 40ec4eeb
  Matthias Redies authored Oct 22, 2019
  
  40ec4eeb
- rename iband1 to jband · 63ae87de
  Matthias Redies authored Oct 22, 2019
  
  63ae87de
- Revert "drop some dummy vars and rename iband1" · 00712bf7
  Matthias Redies authored Oct 22, 2019
```
This reverts commit 96e06c24.
```
  00712bf7
- drop some dummy vars and rename iband1 · 96e06c24
  Matthias Redies authored Oct 22, 2019
  
  96e06c24
21 Oct, 2019 7 commits
- In hybrid/symmetrizeh.F90: Also fill LO-LAPW part in other triangle of Hamiltonian matrix · ceda7bd7
  Gregor Michalicek authored Oct 21, 2019
  
  ceda7bd7
- Update wann_updown.F · dfae603b
  Frank Freimuth authored Oct 21, 2019
  
  dfae603b
- Update CMakeLists.txt · 025f9447
  Frank Freimuth authored Oct 21, 2019
  
  025f9447
- Upload New File · ef607e8f
  Frank Freimuth authored Oct 21, 2019
  
  ef607e8f
- Update CMakeLists.txt · 4b8ec91c
  Frank Freimuth authored Oct 21, 2019
  
  4b8ec91c
- Upload New File · 83fef44d
  Frank Freimuth authored Oct 21, 2019
  
  83fef44d
- more bandgap fixing · dd6fa305
  Matthias Redies authored Oct 21, 2019
  
  dd6fa305