l716.thermochemistry.rotconsts

Implementation level
Type Status
CML extraction template image0
HTML5 representation image1
Template attributes
Attribute Value
source Gaussian log
id l716.thermochemistry.rotconsts
repeat *
pattern \s*Rotational constants \(GHZ).*
endPattern .*
endPattern2 ~
xml:base l716/thermochemistry/l 716.thermochemistry.rotconsts.xml

Input.

Rotational constants (GHZ):         157.33005   157.33005   157.33005

Output text.

<comment class="example.output" id="l716.thermochemistry.rotconsts">
    <module cmlx:templateRef="l716.thermochemistry.rotconsts">
      <array dataType="xsd:double" size="3" dictRef="cc:rotconst" cmlx:templateRef="rotconst">157.33005 157.33005 157.33005</array>
    </module>
  </comment>

Template definition.

<record id="rotconst">\s*Rotational constants \(GHZ\):\s*{3F,cc:rotconst}\s*</record>
<transform process="pullupSingleton" xpath=".//cml:list" />