Skip to content
  • Home
  • Recent
Collapse
Brand Logo
CRYSTAL23
Latest v1.0.1
Tutorials Try the Demo Get a License
Tutorials Try the Demo Get a License Instagram
malliagiuseppeundefined

malliagiuseppe

@malliagiuseppe
Expert
About
Posts
1
Topics
0
Groups
1
Followers
0
Following
0

Posts

Recent Best Controversial

  • fractional coordinate entry
    malliagiuseppeundefined malliagiuseppe

    Hi,
    please try to define the atomic positions with more figures.
    This is important for 1/3 and 2/3 fractional coordinates.

    CRYSTAL
    0 0 0
    164
    3.186 4.653
    3
    27 0.0 0.0 0.0
    1 0.33333333 0.66666666 0.4134
    8 0.33333333 0.66666666 0.2128

    I hope it helps.
    Giuseppe

  • Login

  • Don't have an account? Register

  • Login or register to search.
  • First post
    Last post
0
  • Home
  • Recent