basisecp

Table 411. Implementation level

TypeStatus
CML extraction template

Total implementation

HTML5 representation

Total implementation


Table attributesTable. Template attributes

AttributeValue
source Orca log
idbasisecp
nameECP Parameter Information
pattern\s*-{20}.*$\s*ECP\sPARAMETER\sINFORMATION.*
endPattern\s*Atom.*$\s*
endPattern2\s*$\s*-{20}.*
endPattern3~
endOffset1
repeat*
xml:basebasisecp.xml


Input. 

-------------------------
ECP PARAMETER INFORMATION
-------------------------

 Group 1, Type Ru ECP SD(28,MWB) (replacing 28 core electrons, lmax=4)

Atom   0Ru   ECP group =>   1
	
	

Output text. 

<comment class="example.output" id="basisecp">
  		<module cmlx:templateRef="basisecp">
	        <module cmlx:templateRef="basisgroups">
	           <list cmlx:templateRef="group">
	              <list>
	                 <scalar dataType="xsd:integer" dictRef="o:group">1</scalar>
	                 <scalar dataType="xsd:string" dictRef="cc:elementType">Ru</scalar>
	                 <scalar dataType="xsd:string" dictRef="o:ecptype">ECP SD(28,MWB)</scalar>
	              </list>
	           </list>
	        </module>
	        <module cmlx:templateRef="atombasis">
	           <list cmlx:templateRef="missingID">
	              <list>
	                 <scalar dataType="xsd:integer" dictRef="cc:serial">0</scalar>
	                 <scalar dataType="xsd:string" dictRef="cc:elementType">Ru</scalar>
	                 <scalar dataType="xsd:integer" dictRef="o:group">1</scalar>
	              </list>
	           </list>
	        </module>
	     </module>
	</comment>