mullikenpopulation


Implementation level
Type Status
CML extraction template image0
HTML5 representation image1
Template attributes
Attribute Value
source Orca log
id mullikenpopulation
name Mulliken Population Analysis
pattern \s**{10,}s*$s**s*MULLIK ENsPOPULATIONsANALYSISs**s*
endPattern \s**{10,}s*$s**s*.*
endPattern2 ~
endOffset -1
repeat *
xml:base job/mulliken/mulliken.xml

Comment.

                    ********************************
                    * MULLIKEN POPULATION ANALYSIS *
                    ********************************
...

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

Template definition.

<templateList>  <xi:include href="mulliken/atomiccharges.xml" />  <xi:include href="mulliken/atomicchargesspin.xml" />
    </templateList>