search

tmancal74 / quantarhei

Open Quantum System Theory for Molecular Systems
MIT License
21 stars 16 forks source link

Make CorrelationFunction.get_SpectralDensity() return a numerically calculated spectral density #11

Closed tmancal74 closed 8 years ago

tmancal74 commented 8 years ago

a Numerical rather than a "per definition" version of the spectral density should be returned by this method. The "per definition" version is obtained by constructing SpectralDensity object directly and sometimes it can be obtained analytically. Comparing the numerical and analytical form is a good check.

tmancal74 commented 8 years ago

Done and tested! Acceptance tests coming.