![]() | Name | Last modified | Size | Description |
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![]() | Parent Directory | - | ||
![]() | GEO_OPT_CONVERGED | 2013-03-05 11:57 | 1.2K | |
![]() | at_gas.xyz | 2013-03-05 11:57 | 3.2K | |
![]() | at_gas_noTFA.xyz | 2013-03-05 11:57 | 2.6K | |
![]() | basis | 2013-03-05 11:57 | 3.3K | |
![]() | control | 2013-03-05 11:57 | 2.1K | |
![]() | converged | 2013-03-05 11:57 | 321 | |
![]() | coord | 2013-03-05 11:57 | 5.5K | |
![]() | energy | 2013-03-05 11:57 | 5.9K | |
![]() | forceapprox | 2013-03-05 11:57 | 273K | |
![]() | gradient | 2013-03-05 11:57 | 1.0M | |
![]() | job.last | 2013-03-05 11:57 | 496K | |
![]() | molden.input | 2013-03-05 11:57 | 490K | |
![]() | mos | 2013-03-05 11:57 | 18M | |