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Commits
: Listings
Analyzed
about 1 year
ago. based on code collected
about 1 year
ago.
Jan 18, 2023 — Jan 18, 2024
Showing page 13 of 19
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Date
trunchate chi before making density
Adrian Hurtado
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almost 2 years ago
truncate after multiple and before add in density
Adrian Hurtado
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almost 2 years ago
do not plot all orbitals by default
Adrian Hurtado
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almost 2 years ago
see if this improves out of phase density issue
Adrian Hurtado
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almost 2 years ago
fixed some truly ancient bugs in longfloat in order to extract 220
Robert J. Harrison
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almost 2 years ago
experimenting
Robert J. Harrison
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almost 2 years ago
getting the tutorial started
Robert J. Harrison
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almost 2 years ago
Update README.md
Robert J. Harrison
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almost 2 years ago
Update README.md
Robert J. Harrison
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almost 2 years ago
Switch max sub to 5
Adrian Hurtado
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almost 2 years ago
Merge pull request #466 from m-a-d-n-e-s-s/465-cant-build-with-build_testing=off
fbischoff
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almost 2 years ago
fixed broken build
fbischoff
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almost 2 years ago
Merge pull request #464 from m-a-d-n-e-s-s/evaleev/fix/parsec-nthread
Eduard Valeyev
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almost 2 years ago
amends b2cfe752dd8abd98683ec1bd3891035ee610d86e
Eduard Valeyev
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almost 2 years ago
amends https://github.com/m-a-d-n-e-s-s/madness/pull/463 to set the number of threads correctly when using PaRSEC backend
Eduard Valeyev
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almost 2 years ago
amend a630bf3f to only limit MAD_NUM_THREADS to 64 when using native thread pool
Eduard Valeyev
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almost 2 years ago
Merge pull request #463 from therault/fix-parsec-typo
Eduard Valeyev
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almost 2 years ago
Fix typo in PaRSEC task backend: was using the input parameter instead of the computed value for the number of threads, defaulting to -1 if MADNESS was initialized without specifying a number of threads, even if MAD_NUM_THREADS was set
Thomas Herault
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almost 2 years ago
remove unnecessary printing
Adrian Hurtado
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almost 2 years ago
remove unnecessary printing
Adrian Hurtado
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almost 2 years ago
it works!
Adrian Hurtado
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almost 2 years ago
fix exchange
Adrian Hurtado
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almost 2 years ago
fix copy bug
Adrian Hurtado
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almost 2 years ago
add set_active() function and apply them
Adrian Hurtado
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almost 2 years ago
apply active to res
Adrian Hurtado
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almost 2 years ago
some bsh changes
Adrian Hurtado
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almost 2 years ago
some exchange changes
Adrian Hurtado
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almost 2 years ago
vector of coulomb operators
Adrian Hurtado
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almost 2 years ago
fix e0
Adrian Hurtado
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almost 2 years ago
chnage e0x
Adrian Hurtado
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almost 2 years ago
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