input.file

Implementation level

Type

Status

CML extraction template

image1

HTML5 representation

image2
Template attributes

Attribute

Value

source

ADF log

id

input.file

name

Input file dump

pattern

\s*\(INPUT\sFILE\)\s*

endPattern

\s*(End Input|end input|END INPUT|End input)\s*

endPattern2

\s*$\s*\*{40,}+\s*

endPattern3

~

endOffset

1

repeat

*

xml:base

input.file.xml

Input

(INPUT FILE)

create W /usr/local/adf2007.01/atomicdata/ZORA/TZP/W.4d
xc
lda vwn
gradients becke perdew
end
relativistic scalar zora
corepotentials t12rel <++
W 2
end
end input

Output text

 1<comment class="example.output" id="input.file">
 2      <module cmlx:lineCount="13" cmlx:templateRef="input.file">
 3        <scalar dataType="xsd:string" dictRef="cc:inputLine">(INPUT FILE)</scalar>
 4        <scalar dataType="xsd:string" dictRef="cc:inputLine" />
 5        <scalar dataType="xsd:string" dictRef="cc:inputLine">create W /usr/local/adf2007.01/atomicdata/ZORA/TZP/W.4d</scalar>
 6        <scalar dataType="xsd:string" dictRef="cc:inputLine">xc</scalar>
 7        <scalar dataType="xsd:string" dictRef="cc:inputLine">lda vwn</scalar>
 8        <scalar dataType="xsd:string" dictRef="cc:inputLine">gradients becke perdew</scalar>
 9        <scalar dataType="xsd:string" dictRef="cc:inputLine">end</scalar>
10        <scalar dataType="xsd:string" dictRef="cc:inputLine">relativistic scalar zora</scalar>
11        <scalar dataType="xsd:string" dictRef="cc:inputLine">corepotentials t12rel <++</scalar>
12        <scalar dataType="xsd:string" dictRef="cc:inputLine">W 2</scalar>
13        <scalar dataType="xsd:string" dictRef="cc:inputLine">end</scalar>
14        <scalar dataType="xsd:string" dictRef="cc:inputLine">end input</scalar>
15        <scalar dataType="xsd:string" dictRef="cc:inputLine" />
16      </module>
17    </comment>

Template definition

1<record repeat="*">{X,cc:inputLine}</record>
2<transform process="pullup" xpath=".//cml:scalar" />
3<transform process="delete" xpath=".//cml:list[count(*)=0]" />