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11 Open 29 Closed
11 Open 29 Closed
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Issues list

RFC: Compile CAST unit tests with the same build flags
#40 opened Mar 22, 2021 by schaerfo
@schaerfo
2
Include a good optimizer that can be used with task 2DSCAN enhancement New feature or request
#38 opened May 25, 2020 by S0S-90
1
Improve finding atomtypes enhancement New feature or request
#37 opened May 25, 2020 by S0S-90
Connect CAST to Python 3 instead of Python 2 enhancement New feature or request
#36 opened May 25, 2020 by S0S-90
Remove DFTBaby Interface enhancement New feature or request good first issue Good for newcomers
#35 opened May 25, 2020 by S0S-90
Is it still necessary that CAST supports compilation without openMP? question Further information is requested
#30 opened Sep 17, 2019 by S0S-90
@MichelsBa @JulianEr
1
SOLVADD does not work with chloride ions enhancement New feature or request help wanted Extra attention is needed
#19 opened Feb 25, 2019 by S0S-90
1
Psi4 and Gaussian energy interfaces return only SCF energy bug Something isn't working
#15 opened Jan 16, 2019 by neelix2606
@MichelsBa @JulianEr
2
Describe sections in the CAST Manual and keep sample inputfile "CAST.txt" up-to-date enhancement New feature or request help wanted Extra attention is needed
#14 opened Sep 20, 2018 by S0S-90
2
Linked cell algorithm deactivated for periodic boundaries enhancement New feature or request
#5 opened Jan 22, 2018 by S0S-90
Strange behaviour with TabuSearch
#3 opened Jan 22, 2018 by S0S-90
7
ProTip! Exclude everything labeled bug with -label:bug.