l716.thermochemistry.rotconsts ​
Implementation level ​
| Type | Status |
|---|---|
| CML extraction template |  |
| HTML5 representation |  |
Template attributes ​
| Attribute | Value |
|---|---|
| source | Gaussian log |
| id | l716.thermochemistry.rotconsts |
| repeat | * |
| pattern | \s*Rotational constants \(GHZ\).* |
| endPattern | .* |
| endPattern2 | ~ |
| xml:base | l716/thermochemistry/l716.thermochemistry.rotconsts.xml |
Input ​
Rotational constants (GHZ): 157.33005 157.33005 157.33005
Output text ​
xml
<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 ​
xml
<record id="rotconst">\s*Rotational constants \(GHZ\):\s*{3F,cc:rotconst}\s*</record>
<transform process="pullupSingleton" xpath=".//cml:list" />