[Pw_forum] fqha.x

Shriram Shivaraman ss626 at cornell.edu
Wed Apr 4 15:52:10 CEST 2007


Hi,

  I'm facing some trouble running this program and hope someone can help 
me out. I'm using the dos file generated in example 06 to calculate the 
free energy. But, when I give the input to fqha.x as alas.phdos, for any 
temperature, the free energy turns out to be zero. I'm not sure what is 
going wrong here. Can someone please help?

Thanks,
Shriram



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