![]() | Name | Last modified | Size | Description |
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![]() | Parent Directory | - | ||
![]() | nh3.in | 2018-12-05 21:53 | 361 | |
![]() | nh3.out | 2018-12-05 21:57 | 72K | |
![]() | nh3_phi.in | 2018-12-06 07:12 | 608 | |
![]() | nh3_phi.out | 2018-12-05 22:25 | 407K | |
![]() | nh3_phi.py | 2018-12-06 22:09 | 693 | |
![]() | nh3_phi_b3lyp.in | 2018-12-06 07:11 | 610 | |
![]() | nh3_phi_b3lyp.out | 2018-12-05 22:40 | 490K | |
![]() | pes.dat | 2018-12-05 22:26 | 270 | |
![]() | pes_b3lyp.dat | 2018-12-05 22:41 | 270 | |
![]() | psi.11142.clean | 2018-12-06 21:46 | 35 | |
![]() | psi.29189.clean | 2018-12-06 21:45 | 35 | |
![]() | stdout.default.11142.intco | 2018-12-06 21:46 | 390 | |
![]() | stdout.default.29189.intco | 2018-12-06 21:45 | 390 | |
![]() | timer.dat | 2018-12-06 22:10 | 42K | |