Commit Graph

16 Commits

Author SHA1 Message Date
Phillip Seeber
8e886a7328 libcint: 5.1.6 -> 5.2.1 2023-03-16 10:40:43 +01:00
Guillaume Girol
33afbf39f6 treewide: switch to nativeCheckInputs
checkInputs used to be added to nativeBuildInputs. Now we have
nativeCheckInputs to do that instead. Doing this treewide change allows
to keep hashes identical to before the introduction of
nativeCheckInputs.
2023-01-21 12:00:00 +00:00
Phillip Seeber
a77b44f4f4 libcint: 4.4.6 -> 5.1.6 2022-10-13 11:41:01 +02:00
Phillip Seeber
dd7f587346 libcint: 4.4.0 -> 4.4.6
libcint: formatting and features


libcint: platforms
2021-11-22 12:28:47 +01:00
Drew Risinger
952a0034e8 libcint: 4.3.0 -> 4.4.0 2021-05-05 16:53:49 -04:00
Drew Risinger
c14bf3fcc1 libcint: 4.1.1 -> 4.3.0 2021-04-27 14:34:37 -04:00
Frederik Rietdijk
993f3e4b4e libcint: use python3 2021-04-03 17:06:21 +02:00
R. RyanTM
418ab6338e libcint: 4.1.0 -> 4.1.1 2021-03-22 10:44:40 +00:00
R. RyanTM
fc0697f999 libcint: 4.0.7 -> 4.1.0 2021-02-18 10:40:15 +00:00
R. RyanTM
bd5240489d libcint: 4.0.6 -> 4.0.7 2021-01-19 21:48:02 +00:00
R. RyanTM
2a11c6ceac libcint: 4.0.2 -> 4.0.6 2020-11-15 09:02:30 +00:00
Drew Risinger
6e34b3e6fe libcint: 3.1.1 -> 4.0.2
Add changelog
2020-10-07 09:04:39 -04:00
R. RyanTM
e9945fc57a libcint: 3.0.20 -> 3.1.1 2020-09-05 04:16:46 +00:00
R. RyanTM
403d45064e libcint: 3.0.19 -> 3.0.20 2020-05-19 10:03:21 +00:00
Matthew Bauer
1c8aba8334 treewide: use blas and lapack
This makes packages use lapack and blas, which can wrap different
BLAS/LAPACK implementations.

treewide: cleanup from blas/lapack changes

A few issues in the original treewide:

- can’t assume blas64 is a bool
- unused commented code
2020-04-17 16:24:09 -05:00
Drew Risinger
3e5789a223 libcint: init at 3.0.19
C library of general GTO integrals for quantum chemistry.

Requirement for pyscf, which is a requirement for qiskit-aqua.
2020-02-03 17:11:21 -05:00