How can I apply a unitary transformation to rotate a 3D complex wave function?

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Discussion Overview

The discussion centers on applying a unitary transformation to rotate a 3D complex wave function with respect to an arbitrary axis. Participants explore theoretical approaches and mathematical frameworks relevant to this transformation.

Discussion Character

  • Technical explanation
  • Mathematical reasoning

Main Points Raised

  • Sasha inquires about methods to apply a unitary transformation for rotating a 3D complex wave function.
  • One participant suggests looking into the Schrödinger-Bloch equation and provides references to relevant literature, indicating that these resources might be helpful.
  • Another participant questions whether the wave function has a definite angular momentum and mentions the use of rotation matrices (Dlmm') in that context.
  • A further contribution explains that spatial rotations are generated by angular momentum operators and discusses the evaluation of the operator exponential for a specified rotation axis and angle.

Areas of Agreement / Disagreement

Participants present various approaches and references, but no consensus is reached on a single method or solution for applying the unitary transformation.

Contextual Notes

Some assumptions regarding the properties of the wave function, such as angular momentum characteristics, are not fully explored. The discussion also relies on specific mathematical frameworks that may not be universally applicable without further clarification.

newshurik
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Hello,

I have a 3D complex wave function and I want to apply a unitary transformation to rotate it with respect to arbitrary axis.

Anybody have any ideas how I can do that?

Sasha
 
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Last edited:
Does your wavefunction have a definite angular momentum, i.e. does it contain a spherical harmonic Ylm? If so, you rotate it using a rotation matrix Dlmm'. See a good book on Angular Momentum such as Edmonds.
 
Spatial rotations are generated by the angular momentum operators. So the general answer to your request is picking a representation of the angular momentum operators (Lx,Ly,Lz) and evaluating the operator exponential

exp(i*n.L) = exp(i*(nx*Lx+ny*Ly+nz*Lz))

for a vector (nx,ny,nz) that specifies the axis of rotation and the rotation angle by its magnitude.

In an angular momentum eigenbasis that is aligned with n that unitary operator is diagonal. So you might find expanding in that basis to be simpler than evaluating the most general operator exponential.

Cheers,

Jazz
 

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