[Pw_forum] ph.x v3.2 on NEC SX-8

[Paolo Giannozzi]

On Jan 4, 2007, at 12:17 , wlyim at puccini.che.pitt.edu wrote:

>> There is also a division by another quantity (dz) that is never  
>> smaller
>> than 1.d-6 by construction.

actually I misinterpreted the definition of dz: dz is never LARGER then
1.d-6 by construction. You can simply set dz to a fixed value: 1.d-6, or
1.d-4 .

Paolo
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Paolo Giannozzi, Democritos and University of Udine, Italy