Electron-Transfer (ET) method added to PSPW
Just Got Here
2:03:08 PM PDT - Wed, May 29th 2013
Despite having downloaded, compiled and installed nwchem 6.3 I have not been able to find out how to perform electron transfer calculations using the pspw module, neither in the web page nor inside the source code.

I would be grateful if you could tell me where to find out this information, as well as if pspw ET calculations can be performed for all the functionals already available in the module.

Thank you in advance.


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