Stephan Rix wrote: > Question: Is ph.x in principle capable of calculating transition state > phonon modes, i.e. returning negative/imaginary modes?
it is P. -- Paolo Giannozzi, Democritos and University of Udine, Italy
Stephan Rix wrote: > Question: Is ph.x in principle capable of calculating transition state > phonon modes, i.e. returning negative/imaginary modes?
it is P. -- Paolo Giannozzi, Democritos and University of Udine, Italy