Sapan Agarwal @ 07:28 PM on 17 Aug, 2012

Hi,

I’m running tight binding sp3s* with spin orbit simulations and I found that some of the links between the different materials are missing. For instance in InAs:Bands:TB:sp3sstar_SO:param_Klimeck I’ve added {{{11 rule[$param$_Al_As] = AlAs:Bands:TB:sp3sstar_SO:param_NEMO1D:$param1$_Al_As;

rule[$param$_As_Al] = AlAs:Bands:TB:sp3sstar_SO:param_NEMO1D:$param1$_As_Al; }}

Is it possible to write a similar command to the rule command in the input file or do I need to edit all.mat?

For reference here are the rest of the changes I made.

In AlSb:Bands:TB:sp3sstar_SO:param_Klimeck I’ve added {{{ rule[$param$_Al_As] = AlAs:Bands:TB:sp3sstar_SO:param_NEMO1D:$param1$_Al_As;

rule[$param$_As_Al] = AlAs:Bands:TB:sp3sstar_SO:param_NEMO1D:$param1$_As_Al; }}}

In GaSb:Bands:TB:sp3sstar_SO:param_Klimeck I’ve added {{{ rule[$param$_Al_Sb] = AlSb:Bands:TB:sp3sstar_SO:param_Klimeck:$param1$_Al_Sb;

rule[$param$_Sb_Al] = AlSb:Bands:TB:sp3sstar_SO:param_Klimeck:$param1$_Sb_Al; }}}

Thanks, Sapan