how to fix origin?

Clicked A Few Times	12:06:49 AM PST - Wed, Nov 27th 2013 Dear all, I want to fix origin for comparing charge difference (in bonding) both even using "unset geometry actlist" nwchem changes automatically the origin and atom positions in output differes from input. any comment and help appreciated. thanks in advance. Yavar
Computational and Theoretical Physics Group, AEOI, Tehran, Iran

Forum Regular	11:46:02 AM PST - Wed, Nov 27th 2013 Hi Yavar, I think that specifying the geometry as geometry nocenter noautosym noautoz should do it. Let me know if that does not work. Best wishes, Huub

Clicked A Few Times	4:09:02 PM PST - Mon, Dec 2nd 2013 thanks Dear Huub it works so well and my problem solved thanks for your instructive comment Bests yavar

Clicked A Few Times	4:14:06 PM PST - Mon, Dec 2nd 2013 Dear Huub So sorry for my late answer, I am new NWchem user, and new member I should say thanks again, my prob completely solved, Best wishes Yavar

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