fragment.files

ADF log

Table 21. Implementation level

TypeStatus
CML extraction template

Total implementation

HTML5 representation

None implementation


Table attributesTable. Template attributes

AttributeValue
source ADF log
idfragment.files
nameFragment files section
pattern\s+Fragment\sFile\(s\).*
endPattern\s*
endOffset1
repeat*
xml:basefragment.files.xml


Input. 

 Fragment File(s)
 ----------------
 Lu:
         file : t21.Lu.5p
         jobid: ADF 2012.01  RunTime: Nov11-2013 11:30:15  Nodes: 1  Procs: 1
         title: Lutetium (TZP, 5p frozen)
 N:
         file : t21.N.1s
         jobid: ADF 2012.01  RunTime: Nov11-2013 11:30:16  Nodes: 1  Procs: 1
         title: Nitrogen (TZP, 1s frozen)
 H:
         file : t21.H
         jobid: ADF 2012.01  RunTime: Nov11-2013 11:30:17  Nodes: 1  Procs: 1
         title: Hydrogen (TZP)
 C:
         file : t21.C.1s
         jobid: ADF 2012.01  RunTime: Nov11-2013 11:30:16  Nodes: 1  Procs: 1
         title: Carbon (TZP, 1s frozen)

	

Input. 

 Fragment File(s)
 ----------------
 W:
         file : t21.W.4d
         jobid: ADF 2007.01  RunTime: Oct16-2008 12:08:13
         title: Tungsten (TZP, 4d frozen)
 V:
         file : t21.V.2p
         jobid: ADF 2007.01  RunTime: Oct16-2008 12:08:14
         title: Vanadium (TZP, 2p frozen)
 O:
         file : t21.O.1s
         jobid: ADF 2007.01  RunTime: Oct16-2008 12:08:12
         title: Oxygen (TZP, 1s frozen)

	

Output text. 

<comment class="example.output" id="fragment.files">
		<module cmlx:lineCount="18" cmlx:templateRef="fragment.files">
			<module cmlx:lineCount="18" cmlx:templateRef="fragment.files">
              <list cmlx:templateRef="elementType">
                <atom elementType="Lu" id="a1">
                  <scalar dataType="xsd:string" dictRef="a:file">t21.Lu.5p</scalar>
                  <scalar dataType="xsd:string" dictRef="cc:jobname">ADF 2012.01</scalar>
                  <scalar dataType="xsd:string" dictRef="cc:runtime">Nov11-2013 11:30:15</scalar>
                  <scalar dataType="xsd:integer" dictRef="cc:nodes">1</scalar>
                  <scalar dataType="xsd:integer" dictRef="cc:processors">1</scalar>
                  <scalar dataType="xsd:string" dictRef="cc:elementName">Lutetium</scalar>
                  <scalar dataType="xsd:string" dictRef="cc:basis">TZP</scalar>
                  <scalar dataType="xsd:string" dictRef="cc:contraction">5p</scalar>
                </atom>
              </list>
            </module>
            <module cmlx:lineCount="4" cmlx:templateRef="atom">
              <list cmlx:templateRef="elementType">
                <atom elementType="N" id="a1">
                  <scalar dataType="xsd:string" dictRef="a:file">t21.N.1s</scalar>
                  <scalar dataType="xsd:string" dictRef="cc:jobname">ADF 2012.01</scalar>
                  <scalar dataType="xsd:string" dictRef="cc:runtime">Nov11-2013 11:30:16</scalar>
                  <scalar dataType="xsd:integer" dictRef="cc:nodes">1</scalar>
                  <scalar dataType="xsd:integer" dictRef="cc:processors">1</scalar>
                  <scalar dataType="xsd:string" dictRef="cc:elementName">Nitrogen</scalar>
                  <scalar dataType="xsd:string" dictRef="cc:basis">TZP</scalar>
                  <scalar dataType="xsd:string" dictRef="cc:contraction">1s</scalar>
                </atom>
              </list>
            </module>
            <module cmlx:lineCount="4" cmlx:templateRef="atom">
              <list cmlx:templateRef="elementType">
                <atom elementType="H" id="a1">
                  <scalar dataType="xsd:string" dictRef="a:file">t21.H</scalar>
                  <scalar dataType="xsd:string" dictRef="cc:jobname">ADF 2012.01</scalar>
                  <scalar dataType="xsd:string" dictRef="cc:runtime">Nov11-2013 11:30:17</scalar>
                  <scalar dataType="xsd:integer" dictRef="cc:nodes">1</scalar>
                  <scalar dataType="xsd:integer" dictRef="cc:processors">1</scalar>
                  <scalar dataType="xsd:string" dictRef="cc:elementName">Hydrogen</scalar>
                  <scalar dataType="xsd:string" dictRef="cc:basis">TZP</scalar>
                </atom>
              </list>
            </module>
            <module cmlx:lineCount="4" cmlx:templateRef="atom">
              <list cmlx:templateRef="elementType">
                <atom elementType="C" id="a1">
                  <scalar dataType="xsd:string" dictRef="a:file">t21.C.1s</scalar>
                  <scalar dataType="xsd:string" dictRef="cc:jobname">ADF 2012.01</scalar>
                  <scalar dataType="xsd:string" dictRef="cc:runtime">Nov11-2013 11:30:16</scalar>
                  <scalar dataType="xsd:integer" dictRef="cc:nodes">1</scalar>
                  <scalar dataType="xsd:integer" dictRef="cc:processors">1</scalar>
                  <scalar dataType="xsd:string" dictRef="cc:elementName">Carbon</scalar>
                  <scalar dataType="xsd:string" dictRef="cc:basis">TZP</scalar>
                  <scalar dataType="xsd:string" dictRef="cc:contraction">1s</scalar>
                </atom>
              </list>
            </module>
          </module>	
	</comment>

Output text. 

<comment class="example.output" id="fragment.files2">
	    <module cmlx:lineCount="14" cmlx:templateRef="fragment.files">
	      <module cmlx:lineCount="4" cmlx:templateRef="atom">
	       <list cmlx:templateRef="elementType">
	        <atom elementType="W" id="a1">
	         <scalar dataType="xsd:string" dictRef="a:file">t21.W.4d</scalar>
	         <scalar dataType="xsd:string" dictRef="cc:jobname">ADF 2007.01</scalar>
	         <scalar dataType="xsd:string" dictRef="cc:runtime">Oct16-2008 12:08:13</scalar>
	         <scalar dataType="xsd:string" dictRef="cc:elementName">Tungsten</scalar>
	         <scalar dataType="xsd:string" dictRef="cc:basis">TZP</scalar>
	         <scalar dataType="xsd:string" dictRef="cc:contraction">4d</scalar>
	        </atom>
	       </list>
	      </module>
	      <module cmlx:lineCount="4" cmlx:templateRef="atom">
	       <list cmlx:templateRef="elementType">
	        <atom elementType="V" id="a1">
	         <scalar dataType="xsd:string" dictRef="a:file">t21.V.2p</scalar>
	         <scalar dataType="xsd:string" dictRef="cc:jobname">ADF 2007.01</scalar>
	         <scalar dataType="xsd:string" dictRef="cc:runtime">Oct16-2008 12:08:14</scalar>
	         <scalar dataType="xsd:string" dictRef="cc:elementName">Vanadium</scalar>
	         <scalar dataType="xsd:string" dictRef="cc:basis">TZP</scalar>
	         <scalar dataType="xsd:string" dictRef="cc:contraction">2p</scalar>
	        </atom>
	       </list>
	      </module>
	      <module cmlx:lineCount="4" cmlx:templateRef="atom">
	       <list cmlx:templateRef="elementType">
	        <atom elementType="O" id="a1">
	         <scalar dataType="xsd:string" dictRef="a:file">t21.O.1s</scalar>
	         <scalar dataType="xsd:string" dictRef="cc:jobname">ADF 2007.01</scalar>
	         <scalar dataType="xsd:string" dictRef="cc:runtime">Oct16-2008 12:08:12</scalar>
	         <scalar dataType="xsd:string" dictRef="cc:elementName">Oxygen</scalar>
	         <scalar dataType="xsd:string" dictRef="cc:basis">TZP</scalar>
	         <scalar dataType="xsd:string" dictRef="cc:contraction">1s</scalar>
	        </atom>
	       </list>
	      </module>
	     </module>
	</comment>