User contributions for Klw14

13:0313:03, 22 June 2017 diff hist +12 Talk:Mod:Hunt Research Group/ChemShell files →opt.chm files
13:0013:00, 22 June 2017 diff hist +34 Talk:Mod:Hunt Research Group/ChemShell files →opt.chm files
12:4612:46, 22 June 2017 diff hist +20 Talk:Mod:Hunt Research Group/ChemShell →Input for ChemShell
12:4412:44, 22 June 2017 diff hist +24 Talk:Mod:Hunt Research Group/ChemShell →Input for ChemShell
12:4212:42, 22 June 2017 diff hist +30 Talk:Mod:Hunt Research Group/ChemShell →Input for ChemShell
10:2810:28, 22 June 2017 diff hist +1 Talk:Mod:Hunt Research Group/ChemShell →Input for ChemShell
10:2510:25, 22 June 2017 diff hist +10 Talk:Mod:Hunt Research Group/ChemShell →Input for ChemShell
10:1810:18, 22 June 2017 diff hist 0 Talk:Mod:Hunt Research Group/ChemShell →Input for ChemShell
10:1810:18, 22 June 2017 diff hist +67 Talk:Mod:Hunt Research Group/ChemShell →Input for ChemShell
10:1710:17, 22 June 2017 diff hist −4 Talk:Mod:Hunt Research Group/ChemShell →Input for ChemShell
10:1610:16, 22 June 2017 diff hist +10 Talk:Mod:Hunt Research Group/ChemShell →Input for ChemShell
10:1410:14, 22 June 2017 diff hist +265 Talk:Mod:Hunt Research Group/ChemShell →Input for ChemShell
10:1210:12, 22 June 2017 diff hist +114 Talk:Mod:Hunt Research Group/ChemShell →Input for ChemShell
10:0510:05, 22 June 2017 diff hist +2 Talk:Mod:Hunt Research Group/ChemShell →Input for ChemShell
10:0310:03, 22 June 2017 diff hist +19 Talk:Mod:Hunt Research Group/ChemShell →Input for ChemShell
10:0310:03, 22 June 2017 diff hist +11 Talk:Mod:Hunt Research Group/ChemShell →Input for ChemShell
10:0210:02, 22 June 2017 diff hist +777 Talk:Mod:Hunt Research Group/ChemShell →Input for ChemShell

15:3915:39, 21 June 2017 diff hist +761 Talk:Mod:Hunt Research Group/ChemShell files →ff.dat

16:3916:39, 16 June 2017 diff hist +103 Talk:Mod:Hunt Research Group/ChemShell files →cluster_1.chm
16:2416:24, 16 June 2017 diff hist +680 Talk:Mod:Hunt Research Group/ChemShell files →cluster.pun
16:2416:24, 16 June 2017 diff hist −680 Talk:Mod:Hunt Research Group/ChemShell files →cluster_1.chm
16:2316:23, 16 June 2017 diff hist +680 Talk:Mod:Hunt Research Group/ChemShell files →cluster_1.chm
16:2016:20, 16 June 2017 diff hist −66 Talk:Mod:Hunt Research Group/ChemShell files →ff.dat
16:1716:17, 16 June 2017 diff hist +127 Talk:Mod:Hunt Research Group/ChemShell files No edit summary
15:1315:13, 16 June 2017 diff hist +55 Talk:Mod:Hunt Research Group/ChemShell files →opt.chm files
15:1115:11, 16 June 2017 diff hist +1 Talk:Mod:Hunt Research Group/ChemShell files →opt.chm files
15:1115:11, 16 June 2017 diff hist +2 Talk:Mod:Hunt Research Group/ChemShell files →opt.chm files
15:1015:10, 16 June 2017 diff hist +6 Talk:Mod:Hunt Research Group/ChemShell files No edit summary
15:0515:05, 16 June 2017 diff hist +133 Talk:Mod:Hunt Research Group/ChemShell files No edit summary
14:5214:52, 16 June 2017 diff hist +2,794 N Talk:Mod:Hunt Research Group/ChemShell files Created page with "===opt.chm files=== An example of an opt.hm file can be seen below. <pre> dl-find coords=cluster.pun\ theory=hybrid: { coupling=shift \ cutoff = 20 \ qm_re..."
14:3514:35, 16 June 2017 diff hist +126 Mod:Hunt Research Group →Running QM/MM Simulations in ChemShell

10:2810:28, 5 June 2017 diff hist +18 Mod:Hunt Research Group/calendar No edit summary
10:2710:27, 5 June 2017 diff hist +2 Mod:Hunt Research Group/calendar No edit summary
10:2610:26, 5 June 2017 diff hist −4 Mod:Hunt Research Group/calendar No edit summary
10:2210:22, 5 June 2017 diff hist +81 Mod:Hunt Research Group/calendar No edit summary
10:2110:21, 5 June 2017 diff hist +13 Mod:Hunt Research Group/calendar No edit summary
10:2010:20, 5 June 2017 diff hist −422 Mod:Hunt Research Group/calendar No edit summary

09:5209:52, 15 May 2017 diff hist +1,499 N Mod:Hunt Research Group:aim pseudopotentials Created page with "==AimAll with Pseudopotentials== This page is to explain how to generate files that can be used within AimAll. ===Generating the .wfx file=== When generating files for ch..."
09:2809:28, 15 May 2017 diff hist +129 Mod:Hunt Research Group →Gaussian General