Theoretical calculations of mechanical properties using Wien2k software gives only the bulk, Young and shear modulus also c11, c12 and c44 values. Under pressure I can able to calculate the strain. But how can I calculate the shear stress?
Philip James Hasnip
Dear Viswanathan,
I've just posted a reply to a similar question at:
https://www.researchgate.net/post/How_to_change_the_uniform_strain_and_tensile_strain_apply_on_system
hopefully that will help you. If not, post back here and I'll do my best to clarfy things.
All the best,
Phil Hasnip
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Lt. Dr. Viswanathan Ekambaram
Not how to plot the graph. It is how to calculate shear stress theoretically?
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