CV:AXANG: Difference between revisions
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(Created page with "__NOEDITSECTION__ Navigation: Documentation / Collective Variables / CV:AXANG ---- {{CVS}} ===Definition=== The angle between two axes of two principal moments of...") |
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| single atom specifying the end of approximate vector in the direction of principal moment. The vector origin is in '''A'''<sub>com</sub>. The atom must be member of the group '''A''' | | single atom specifying the end of approximate vector in the direction of principal moment. The vector origin is in '''A'''<sub>com</sub>. The atom must be member of the group '''A''' | ||
|- | |- | ||
| '''direction_a''' | | '''direction_a''' | ||
| x, y, z | | x, y, z | ||
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| | | selection of corresponding principal moment vector | ||
|- | |- | ||
| '''group_b''' | | '''group_b''' | ||
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| [[Mask format|mask]] | | [[Mask format|mask]] | ||
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| single atom specifying the end of approximate vector in the direction of principal moment. The vector origin is in '''B'''<sub>com</sub>. The atom must be member of the group '''B''' | | single atom specifying the end of approximate vector in the direction of principal moment. The vector origin is in '''B'''<sub>com</sub>. The atom must be member of the group '''B''' | ||
|- | |- | ||
| '''direction_b''' | | '''direction_b''' | ||
| x, y, z | | x, y, z | ||
| | | | ||
| | | selection of corresponding principal moment vector | ||
|} | |} | ||
''Keys in bold are mandatory.'' | ''Keys in bold are mandatory.'' | ||