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RagnarB83 / ash

ASH is a Python-based computational chemistry and QM/MM environment, primarily for molecular calculations in the gas phase, explicit solution, crystal or protein environment.
GNU General Public License v2.0
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QRRHO #353

Closed RagnarB83 closed 1 year ago

RagnarB83 commented 1 year ago

Add this, with variable omega_0

RagnarB83 commented 1 year ago

Now implemented in NEW branch