Skip to content

Commit 570749a

Browse files
mazeaumazeau
authored
Merge branch 'master' into recipe
2 parents 0ac7878 + a87d79f commit 570749a

33 files changed

+298
-98
lines changed

‎arkane/data/B2PLYP.LOG‎ renamed to ‎arkane/data/gaussian/B2PLYP.LOG‎

File renamed without changes.

‎arkane/data/UCCSDT_C_ATOM.LOG‎ renamed to ‎arkane/data/gaussian/UCCSDT_C_ATOM.LOG‎

File renamed without changes.

‎arkane/data/UCCSD_C_ATOM.LOG‎ renamed to ‎arkane/data/gaussian/UCCSD_C_ATOM.LOG‎

File renamed without changes.

‎arkane/data/UMP2_C_ATOM.LOG‎ renamed to ‎arkane/data/gaussian/UMP2_C_ATOM.LOG‎

File renamed without changes.

‎arkane/data/error_termination.out‎ renamed to ‎arkane/data/gaussian/error_termination.out‎

File renamed without changes.

‎arkane/data/hr_scan_with_freq.log‎ renamed to ‎arkane/data/gaussian/hr_scan_with_freq.log‎

File renamed without changes.

‎arkane/data/isobutanolQOOH_scan.log‎ renamed to ‎arkane/data/gaussian/isobutanolQOOH_scan.log‎

File renamed without changes.

‎arkane/data/Orca_TS_test.log‎ renamed to ‎arkane/data/orca/Orca_TS_test.log‎

File renamed without changes.

‎arkane/data/Orca_dlpno_test.log‎ renamed to ‎arkane/data/orca/Orca_dlpno_test.log‎

File renamed without changes.

‎arkane/data/Orca_opt_freq_test.log‎ renamed to ‎arkane/data/orca/Orca_opt_freq_test.log‎

File renamed without changes.

0 commit comments

Comments
 (0)