bernstei

multiple maps with the same PCA vectors

2

It would be useful to do maps of multiple data sets in the same space (e.g. same PCA vectors), side by side (multiple panels on the same page), colored by...

STIG guidance leads to inconsistent failed password account locking time

3

A DISA STIG baseline leads to inconsistent failed password unlock times in the mobileconfig and guidance ``` ./scripts/generate_baseline.py -k stig ./scripts/generate_guidance.py -p -s build/baselines/stig.yaml ``` In Sec 10.3, it says...

Running `generate_guidance.py` under python 3.12 leads to many `SyntaxWarning`, e.g. ``` ./scripts/generate_guidance.py:2112: SyntaxWarning: invalid escape sequence '\|' rule_id=rule_yaml['id'].replace('|', '\|'), ``` It appears that most recent python syntax interprets `'\|'` as...

report line number of julia exception

3

It would be very helpful if `julia.Main.eval(str)` reported the line number in the code string that raised the exception, as opposed to just repeating back the whole string. Is there...

pip install fails because it can't find mkl.h

16

I just tried updating to the latest pip version (0.6.4), and it fails with ``` gcc -Wno-unused-result -Wsign-compare -DNDEBUG -O2 -g -pipe -Wall -Wp,-D_FORTIFY_SOURCE=2 -fexceptions -fstack-protector-strong --param=ssp-buffer-size=4 -grecord-gcc-switches -m64 -mtune=generic...

explicit tests comparing pawpyseed's all-electron WF and VASP's internal calculations

3

We've been trying to reproduce VASP's internal calculations of optical transition matrix elements - that's not what we really want, but just to convince ourselves that we have the right...

access to wavefunctions without projectors

2

If there is an interface to pseudo-wavefunctions (as opposed to all electron with PAW projector contributions), I haven't found it, so maybe it could use better documentation. If there isn't,...

using for ssh key from a smartcard times out in a weird way

13

I'm using keychain-pkcs11 to authenticate to SSH using a smartcard-derived key by doing `ssh-add -s /usr/local/lib/keychain-pkcs11.dylib`. This works fine initially, but if some time passes, the PIN seems to time...

Is there a summary of what needs to be done when switching from `thermocepstrum-analysis` to `sportran-analysis`? I had used thermocepstrum for a few years, and just upgraded machines and hence...

temperature in "Temp" column isn't sufficient

2

I'm trying to run `sportran-analysis` with a table that has a column for temperature, one for volume, and 48 for flux components (xyz x 16 independent runs). I get the...