preddelta

Implementation level

Type	Status
CML extraction template
HTML5 representation

Template attributes

Attribute	Value
source	Gaussian log
id	preddelta
repeat	*
name	Predicted change in Energy
pattern	\s*Predicted change in Energy.*
endPattern	\s*.*
endPattern2	~
xml:base	l103/l103.preddelta.xml

Input

 Predicted change in Energy=-9.782485D-04

Output text

<comment class="example.output" id="l103.preddelta">
    <module cmlx:templateRef="preddelta">
      <list cmlx:templateRef="predicted">
        <scalar dataType="xsd:double" dictRef="g:predchange">-9.782485E-4</scalar>
      </list>
    </module>
  </comment>

Template definition

<record id="predicted">\s*Predicted change in Energy=&#123;E,g:predchange&#125;.*</record>
<templateList>  <xi:include href="l103/l103.catchall.xml" />
  </templateList>