modified on 17 March 2011 at 17:13 ••• 1,747 views

P3m1

From NWChem

Revision as of 17:13, 17 March 2011 by Bylaska (Talk | contribs)
(diff) ← Older revision | Latest revision (diff) | Newer revision → (diff)
Jump to: navigation, search
group number                 = 156
group name                   =       P3m1
crystal system               = Trigonal
setting number               = 1
number of symmetry operators = 6

+x,+y,+z
-y,+x-y,+z
-x+y,-x,+z
-y,-x,+z
-x+y,+y,+z
+x,+x-y,+z

= operator 1 =
 1.0 0.0 0.0 0.0
 0.0 1.0 0.0 0.0
 0.0 0.0 1.0 0.0

= operator 2 =
 0.0 -1.0 0.0 0.0
 1.0 -1.0 0.0 0.0
 0.0 0.0 1.0 0.0

= operator 3 =
 -1.0 1.0 0.0 0.0
 -1.0 0.0 0.0 0.0
 0.0 0.0 1.0 0.0

= operator 4 =
 0.0 -1.0 0.0 0.0
 -1.0 0.0 0.0 0.0
 0.0 0.0 1.0 0.0

= operator 5 =
 -1.0 1.0 0.0 0.0
 0.0 1.0 0.0 0.0
 0.0 0.0 1.0 0.0

= operator 6 =
 1.0 0.0 0.0 0.0
 1.0 -1.0 0.0 0.0
 0.0 0.0 1.0 0.0