Input View
The input file can be opened in the web browser when the right xslt template is associated with it.
The browser shows a jmol view of your structure and all the used input elements with links to their documentation.
header for this to work:
<?xml version="1.0" encoding="UTF-8"?> <?xml-stylesheet href="inputtohtml.xsl" type="text/xsl"?> <input xsi:noNamespaceSchemaLocation="excitinginput.xsd" xmlns:xsi="http://www.w3.org/2001/XMLSchema-instance" xsltpath="../../../xml/" scratchpath="/tmp/chm/1"> <title></title> <structure speciespath="../../species/" autormt="true" primcell="true"> <crystal> <basevect>9.99476 0.00000 0.00000</basevect> <basevect> 0.00000 9.99476 0.00000</basevect> <basevect> 0.00000 0.00000 19.6966</basevect> </crystal> <species speciesfile="Cu.xml"> <atom coord="0.0000 0.0000 0.0000" bfcmt="0.0000 0.0000 0.0000"></atom> <atom coord="0.0000 0.5000 0.2500" bfcmt="0.0000 0.0000 0.0000"></atom> <atom coord="0.5000 0.0000 0.7500" bfcmt="0.0000 0.0000 0.0000"></atom> <atom coord="0.5000 0.5000 0.5000" bfcmt="0.0000 0.0000 0.0000"></atom> </species> <species speciesfile="Fe.xml"> <atom coord="0.0000 0.0000 0.5000" bfcmt="0.0000 0.0000 0.0000"></atom> <atom coord="0.0000 0.5000 0.7500" bfcmt="0.0000 0.0000 0.0000"></atom> <atom coord="0.5000 0.0000 0.2500" bfcmt="0.0000 0.0000 0.0000"></atom> <atom coord="0.5000 0.5000 0.0000" bfcmt="0.0000 0.0000 0.0000"></atom> </species> <species speciesfile="S.xml"> <atom coord="0.2574 0.2500 0.1250" bfcmt="0.0000 0.0000 0.0000"></atom> <atom coord="0.7426 0.7500 0.1250" bfcmt="0.0000 0.0000 0.0000"></atom> <atom coord="0.2500 0.7426 0.8750" bfcmt="0.0000 0.0000 0.0000"></atom> <atom coord="0.7500 0.2574 0.8750" bfcmt="0.0000 0.0000 0.0000"></atom> <atom coord="0.7574 0.7500 0.6250" bfcmt="0.0000 0.0000 0.0000"></atom> <atom coord="0.2426 0.2500 0.6250" bfcmt="0.0000 0.0000 0.0000"></atom> <atom coord="0.7500 0.2426 0.3750" bfcmt="0.0000 0.0000 0.0000"></atom> <atom coord="0.2500 0.7574 0.3750" bfcmt="0.0000 0.0000 0.0000"></atom> </species> </structure> <groundstate solver="Arpack" fromscratch="true" ngridk="2 2 2"></groundstate> <properties></properties> </input>
Remark: In order for the structure display to work right one has to use the "chemicalSymbol" attribute in the species elements.
