adit

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• Joined on Jun 16, 2022

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adit pushed to main at CoreDev/CMMDE

• 5110c9d0d5 Correct the freezing bond for GOAT-REACT

8 months ago

adit pushed to main at CoreDev/CMMDE

• 9ac789e8fd update features for ORCA6

8 months ago

adit pushed to main at CoreDev/CMMDE

• ad771196a6 update features for ORCA6

8 months ago

adit pushed to main at CoreDev/CMMDE

• 410a542883 update features for ORCA6

9 months ago

adit pushed to main at CoreDev/CMMDE

• 70ea631437 update features for ORCA6

9 months ago

adit pushed to main at CoreDev/CMMDE

• 03ab66ef78 update features for ORCA6

9 months ago

adit pushed to main at CoreDev/CMMDE

• da8871cde3 update features for ORCA6

9 months ago

adit pushed to main at CoreDev/CMMDE

• 2dd312b99b update and bug fix

11 months ago

adit pushed to main at CoreDev/CMMDE

• d577c73c60 update and bug fix
• 5b3599bb9a update
• 53b3d378c4 update
• Compare 3 commits »

11 months ago

adit pushed to main at CoreDev/CMMDE

• 0ded9d1126 bug fix for DCDFTB

1 year ago

adit pushed to main at CoreDev/CMMDE

• 50197aaf02 fix bug with the temperature in -s gromacs

1 year ago

adit pushed to main at CoreDev/CMMDE

• b316af7e71 change -slurm to -q

2 years ago

adit pushed to main at CoreDev/CMMDE

• 0564066980 update

2 years ago

adit pushed to main at CoreDev/CMMDE

• 4d6984f885 Bug fix

2 years ago

adit pushed to main at CoreDev/CMMDE

• 2e296b4997 Modified DCDFTBMD

2 years ago

adit pushed to main at CoreDev/CMMDE

• 54e5e463a3 modreadme

2 years ago

adit pushed to main at CoreDev/CMMDE

• c895649a55 update README

2 years ago

adit pushed to main at CoreDev/CMMDE

• a6d99530c4 update README

2 years ago

adit pushed to main at CoreDev/CMMDE

• 8032b6879d update

2 years ago

adit pushed to main at CoreDev/CMMDE

• be5cb3dce0 add XTB1 to the DFTB+ module

3 years ago

adit pushed to main at CoreDev/CMMDE

• 500f7c3fd1 added non-slurm calculations

3 years ago

adit pushed to main at CoreDev/CMMDE

• 64a32ccbc6 mod README

3 years ago

adit pushed to main at CoreDev/CMMDE

• 2cd971f53f mod README

3 years ago

adit pushed to main at CoreDev/CMMDE

• 56499c6113 mod README

3 years ago

adit pushed to main at CoreDev/CMMDE

• 8f9fb4cdea mod README

3 years ago

adit pushed to main at CoreDev/CMMDE

• 322ddc4ad6 mod README

3 years ago

adit pushed to main at CoreDev/CMMDE

• 59f4a8b40a mod gui

3 years ago

adit pushed to main at CoreDev/CMMDE

• 7f5f956250 mod install.sh

3 years ago

adit pushed to main at CoreDev/CMMDE

• ca974276b6 mod gui

3 years ago

adit pushed to main at CoreDev/CMMDE

• bb901c7ae1 mod gui

3 years ago