Dear Peter Blaha Sir,
Thank you very much for your reply. My
problem is resolved.
regards,
Shamik Chakrabarti
On Thu, Mar 4, 2010 at 1:20 PM, Peter Blaha pblaha at
theochem.tuwien.ac.atwrote:
Useeplot_lapw from the commandline.
or plot case.eosfitb with your favorite plotting program.
shamik chakrabarti schrieb:
Dear Wien2k Users,
After volume optimization if we plot V vs E
using different SCF files we get a plot showing fitting of Murnaghan
equation of state. If we want to see the plotting for fitting of
*Birch-Murnaghan* equation of state what should we do?we are getting
V0 and E0 for both the fitting Murnaghan and Birch-Murnaghan equation of
state but the plot showing fitting of only the Murnaghan equation of state.
Thanks in advance.
regards,
Shamik Chakrabarti
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P.Blaha
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Peter BLAHA, Inst.f. Materials Chemistry, TU Vienna, A-1060 Vienna
Phone: +43-1-58801-15671 FAX: +43-1-58801-15698
Email: blaha at theochem.tuwien.ac.atWWW:
http://info.tuwien.ac.at/theochem/
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