adf.build

Table 31. Implementation level

TypeStatus
CML extraction template

Total implementation

HTML5 representation

None implementation


Table attributesTable. Template attributes

AttributeValue
source ADF log
idadf.build
repeat*
pattern\s+\*\s+B\sU\sI\sL\sD\s\:\s\(Fragments\,\sFunctions\).*
endPattern\s*\d*\s*$\s\*{20,}.*$(\s*|\s*LOGFILE.*)
offset-1
endOffset2
xml:basebuild/build_fragments.xml


Comment. 

                                      ****************************************
                                      *  B U I L D : (Fragments, Functions)  *
                                      ****************************************
                                     
 =======
 S F O s  ***  (Symmetrized Fragment Orbitals)  ***
 =======
  
 SFOs are linear combinations of (valence) Fragment Orbitals (FOs), such that the SFOs transform as the
 irreducible representations of the (molecular) symmetry group. Each SFO is therefore characterized by
 an irrep of the molecule and by a few (or only one) generating FOs
 
 ....

 ***************************************************************************************************