The ABINIT Users Mailing List ( CLOSED )

[coldwind1978@yahoo.com.cn]

Dear all users:

when i do RF calculation at Gpoint, the wfk from GS calculation in dataset1 
cann't be read by RF caculation in Dataset2,the error appear:
inwffil: ERROR
-P-0000   The file /home/zzy/abinit-4.4.4/Tutorial/rfGo_DS1_WFK cannot be 
used to start the
-P-0000   present calculation. It was asked that the wavefunctions be 
accurate, but
-P-0000   at least one of the k points could not be generated from a 
symmetrical one.
-P-0000   dksqmax=    3.307719E-04
-P-0000   Action: check your wf file and k point input variables.
please tell me how to slove the problem?
in the error information, please tell me what's tha meaning of dksqmax?
i appreciate your help!


Regards

                                                        zhuzhenye