[gmx-users] Fwd: Help on the vector component

Ankita Naithani ankitanaithani at gmail.com
Sun Nov 24 14:38:27 CET 2013


Hi,

I wanted some help regarding vector components. I.e. when we use the
g_anaeig command with a flag of -comp, it outputs a file of the
corresponding eigenvector per atom. So, the x-axis has the atom number and
the Y-axis has the total, x, y and z components. I am not sure about what
do they mean? Also, what are the units of these components? Like the
numbers on Y-axis, what are the corresponding units? I would be really
grateful if anyone could kindly help me on this.
Apologies for reposting but was wondering if anyone has any thoughts on it?

Best wishes,

-- 
Ankita Naithani



-- 
Ankita Naithani


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