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add libint2 #22060

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add libint2 #22060

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eb614e8
initial recipe
loriab Feb 17, 2023
5b3fdf9
line continue
loriab Feb 17, 2023
a587463
add osx, win
loriab Feb 17, 2023
e075d36
expand testing
loriab Feb 17, 2023
01a907b
further testing
loriab Feb 17, 2023
87bb1d7
iter
loriab Feb 17, 2023
05c3f42
select py
loriab Feb 17, 2023
f6fd87d
another compiler
loriab Feb 17, 2023
940dbcb
better win call
loriab Feb 17, 2023
af8bf97
still trying to call the exe
loriab Feb 17, 2023
d1b02c1
try production source
loriab Feb 17, 2023
8a9e3b4
try again windows
loriab Feb 18, 2023
09c4a15
try source w/o f12 integrals
loriab Feb 19, 2023
c8c2f1c
poke
loriab Feb 19, 2023
b051100
no win opt
loriab Feb 19, 2023
cc5077c
still smaller for W
loriab Feb 20, 2023
1375554
still smaller
loriab Feb 20, 2023
cfb7281
little bigger
loriab Feb 20, 2023
06be8ca
tweak datadir
loriab Feb 21, 2023
81a5ae7
large src
loriab Feb 21, 2023
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poke
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@loriab
loriab committed Feb 19, 2023
commit c8c2f1caf34b2587e9394942603c8fc06d8df8c6
2 changes: 1 addition & 1 deletion recipes/libint2/meta.yaml
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Expand Up @@ -100,7 +100,7 @@ about:
- LICENSE
- COPYING.LESSER
license_family: LGPL
summary: "E. Valeev and J. Fermann's two-body Gaussian molecular integrals"
summary: "E. Valeev's two-body Gaussian molecular integrals"

extra:
recipe-maintainers:
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