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qbox
qbox-public
Commits
5f80ef8b
Commit
5f80ef8b
authored
Apr 14, 2019
by
Francois Gygi
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rel1_67_0
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800aeee4
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release.C
src/release.C
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src/notes
View file @
5f80ef8b
--------------------------------------------------------------------------------
rel1_67_0
--------------------------------------------------------------------------------
c1bad59 Restore scaling of alpha_start in CGIonicStepper.C
8ab5bfa Fix force_tol and stress_tol convergence test in BOSampleStepper.C
a7c7157 Fix test convergence test of force_tol and stress_tol
61ac1c1 Add optional VERSION macro in qb.C and Makefile
0ed5ed8 Add force_tol and stress_tol variables
ef0e7eb Adjust params in CGIonicStepper, remove rescaling of alpha_start
4a664cb Change beta_max in testCGOptimizer
66305fd Add set_nstep_max function to LineMinimizer
e800eeb Fix PlotCmd argument parsing for -vlocal with nspin=2
--------------------------------------------------------------------------------
rel1_66_3
--------------------------------------------------------------------------------
23da694 Adjust atomic radii. Update logic of non-scf loop termination.
...
...
@@ -100,18 +112,6 @@ e85f85d Changed logic of shifts: zero shifts include Gamma
25f2f96 Generate xyz file from kpoint file
718452c Changed bisection tolerance from 1.0 to 0.001
--------------------------------------------------------------------------------
rel1_63_10
--------------------------------------------------------------------------------
a04d421 Merge branch 'develop'
058730d Implemented PSDA for complex wave functions
26c3495 Update printing of electronic charge & net charge
c102a32 Add testSampleReader program
8f85701 Add option to define constraint with current value
35f2374 changed output format of constraint value, force
e85f85d Changed kpgen logic of shifts: zero shifts include Gamma
25f2f96 Generate xyz file from kpoint file
718452c Changed bisection tolerance from 1.0 to 0.001
--------------------------------------------------------------------------------
rel1_63_9
--------------------------------------------------------------------------------
5310d81 Fix discontinuity in torsion constraint function
...
...
src/release.C
View file @
5f80ef8b
...
...
@@ -19,5 +19,5 @@
#include "release.h"
std
::
string
release
(
void
)
{
return
std
::
string
(
"1.6
6.3
"
);
return
std
::
string
(
"1.6
7.0
"
);
}
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