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integral for z new bounds
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bbbursik committed Jan 23, 2023
commit bb5b4a4b9ba62b9c9fdb0620de5464d718e02dbd
2 changes: 1 addition & 1 deletion docs/theory/dft/pdgt.md
Original file line number Diff line number Diff line change
Expand Up @@ -49,5 +49,5 @@ $$ \gamma=\frac{F-\mu N+pV}{A}=\int_{\rho^\mathrm{V}}^{\rho^\mathrm{L}} \sqrt{

Thus, no iterative solver is necessary to calculate the surface tension of pure components, which is a major advantage of pDGT. Finally, the density profile can be calculated from

$$ z=\int_{\rho^\mathrm{V}}^{\rho^\mathrm{L}} \sqrt{\frac{c/2}{ f(\rho)-\rho\mu+p} } d\rho $$
$$ z(\rho)=\int_{\rho^\mathrm{V}}^{\rho} \sqrt{\frac{c/2}{ f(\rho)-\rho\mu+p} } d\rho $$