Recent content by digermane

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    Graduate How Can You Determine the Wavefunction ψ(r) from Electron Density |\psi(r)|^2?

    I have a 3 dimensional orbital-specfic electron density function ( |\psi(r)|2 ) for all relevant r values. How would I go about finding the corresponding \psi(r)? I know it would be something related to a Fourier transform, I'm just unsure about how to go about performing it in mathematica or...