Commits

Commits on Jun 11, 2024

Remove libint1 and erd integral engines. (#2503 )

jturney
and
loriab
committedJun 11, 2024

Commits on Nov 8, 2023

Fixes building from source (#3073 )
jturney
committedNov 8, 2023

Commits on Apr 7, 2022

Bring in F12 integrals from libint2 (#2502 )

committedApr 7, 2022

Commits on Oct 4, 2021

Merge pull request #2273 from psi4/loriab-patch-1
jturney
committedOct 4, 2021

Commits on Sep 28, 2021

Merge pull request #2293 from loriab/sept21qcdb
jturney
committedSep 28, 2021

Commits on Sep 2, 2021

Merge pull request #2285 from JonathonMisiewicz/ediis
jturney
committedSep 2, 2021

Commits on Aug 6, 2021

Merge pull request #2268 from psi4/loriab-patch-1
jturney
committedAug 6, 2021
Merge pull request #2257 from JonathonMisiewicz/dmrg
jturney
committedAug 6, 2021

Commits on Jul 17, 2021

Merge pull request #2248 from psi4/JonathonMisiewicz-patch-2
jturney
committedJul 17, 2021
Merge pull request #2249 from psi4/JonathonMisiewicz-patch-1
jturney
committedJul 17, 2021

Commits on Jun 28, 2021

Merge pull request #2222 from PeterKraus/i2012
jturney
committedJun 28, 2021

Commits on Jun 25, 2021

Merge pull request #2156 from lazaroid/tdscf_print_extra
jturney
committedJun 25, 2021

Commits on Apr 27, 2021

Merge pull request #2168 from JonathonMisiewicz/fc-df-dct
jturney
committedApr 27, 2021
Merge pull request #2167 from psi4/loriab-patch-1
jturney
committedApr 27, 2021

Commits on Apr 23, 2021

Merge pull request #2165 from JonathonMisiewicz/fc-df-dct
jturney
committedApr 23, 2021

Commits on Apr 21, 2021

Merge pull request #2159 from psi4/jturney-patch-1
jturney
committedApr 21, 2021
Adds -O0 to the default CMAKE_C*_FLAGS_DEBUG variable
jturney
committedApr 21, 2021
Restores debug symbols in Debug/RelWithDebInfo
jturney
committedApr 21, 2021

Commits on Mar 25, 2021

Merge pull request #2140 from maxscheurer/cppe_ci
jturney
committedMar 25, 2021

Commits on Mar 22, 2021

Merge pull request #2137 from JonathonMisiewicz/2136
jturney
committedMar 22, 2021

Commits on Feb 15, 2021

Merge pull request #2113 from loriab/libxc_512
jturney
committedFeb 15, 2021

Commits on Feb 10, 2021

Merge pull request #2107 from JonathonMisiewicz/dump_dump_ints
jturney
committedFeb 10, 2021

Commits on Jan 1, 2021

Merge pull request #2061 from loriab/br2020
jturney
committedJan 1, 2021

Commits on Dec 14, 2020

Merge pull request #2065 from loriab/misc_dec
jturney
committedDec 14, 2020

Commits on Nov 20, 2020

Merge pull request #2038 from obrien951/jsoblgtm
jturney
committedNov 20, 2020

Commits on Nov 16, 2020

Merge pull request #2030 from hokru/PSIO_print
jturney
committedNov 16, 2020
Merge pull request #2032 from SimonBoothroyd/electric-field-in-memory
jturney
committedNov 16, 2020

Commits on Nov 13, 2020

Merge pull request #2033 from JonathonMisiewicz/patch-1
jturney
committedNov 13, 2020

Commits on Sep 9, 2020

Use libint2::vector and cast puream to bool

jturney
authored and
andysim
committedSep 9, 2020
Fixes typo and missing headers.

jturney
authored and
andysim
committedSep 9, 2020
Silences macro redefinition warnings

jturney
authored and
andysim
committedSep 9, 2020

Commits on Jun 10, 2020

Moves import of qcelemental in main Psi4 script. (#1925 )
jturney
committedJun 10, 2020

Commits on Mar 6, 2020

Merge pull request #1829 from JonathonMisiewicz/heal_pcg
jturney
committedMar 6, 2020

Commits on Mar 2, 2020

Merge pull request #1823 from loriab/safeforqcel2018
jturney
committedMar 2, 2020
Merge pull request #1824 from susilehtola/cholesky_gershgorin
jturney
committedMar 2, 2020