Author Topic: external electrostatic fields and turbomole modules  (Read 3758 times)

vspata0

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external electrostatic fields and turbomole modules
« on: June 10, 2014, 10:48:40 PM »
Hi,
  I am trying to incorporate an external electrostatic field into an adc(2) singlepoint with the ricc2 module.  When the calculation reaches ricc2 it freezes up after defining the basis set.  Is it possible to do this with the ricc2 module?  The section on this in the manual in chapter 4 is very brief without a complete description.  Any help is greatly appreciated.
Vince