l716.thermochemistry.vibtemp

Implementation level

Type	Status
CML extraction template
HTML5 representation

Template attributes

Attribute	Value
source	Gaussian log
id	l716.thermochemistry.vibtemp
repeat	*
pattern	\s*Vibrational temperatures.*
endPattern	\s*
xml:base	l716/thermochemistry/l716.thermochemistry.vibtemp.xml

Input

 Vibrational temperatures:   1976.16  1976.16  1976.16  2293.35  2293.35
          (Kelvin)           4393.44  4552.17  4552.17  4552.17

Output text

<comment class="example.output" id="l716.thermochemistry.vibtemp">
    <module cmlx:templateRef="l716.thermochemistry.vibtemp">
      <array dataType="xsd:double" size="9" dictRef="cc:vibtemp">1976.16 1976.16 1976.16 2293.35 2293.35 4393.44 4552.17 4552.17 4552.17</array>
    </module>
  </comment>

Template definition

<record id="vibtemp">\s*Vibrational temperatures: \s*&#123;1_5F,cc:vibtemp&#125;\s*</record>
<record id="vibtemp" repeat="*">\s*(?:\(Kelvin\))?\s*&#123;1_5F,x:x&#125;\s*</record>
<transform process="joinArrays" xpath=".//cml:array" />
<transform process="pullup" xpath=".//cml:array" />
<transform process="delete" xpath="./cml:list" />