Dear Wien2k designers and users, I want to get the wave function in detail,i.e coeffeients like Alm Blm,including radical wave function.However,I do not understand the radwf file.The file looks like:
1 781 0.0000050000 0.0168235428 2.5000000000 0 0.4516540749E-03 -0.1814795270E-01 0.3775008355E-04 -0.1516839477E-02 0.0000000000E+00 0.0000000000E+00 0.8145568709E-03 -0.3272978234E-01 0.0000000000E+00 0.0000000000E+00 0.4580948729E-03 -0.1840675098E-01 0.3828841736E-04 -0.1538470316E-02 0.0000000000E+00 0.0000000000E+00 0.8261728322E-03 -0.3319652432E-01 0.0000000000E+00 0.0000000000E+00 0.4646275196E-03 -0.1866923984E-01 0.3883442807E-04 -0.1560409621E-02 0.0000000000E+00 0.0000000000E+00 0.8379544425E-03 -0.3366992225E-01 0.0000000000E+00 0.0000000000E+00 0.4712520696E-03 -0.1893546721E-01 0.3938812020E-04 -0.1582661405E-02 0.0000000000E+00 0.0000000000E+00 0.8499018002E-03 -0.3415006250E-01 0.0000000000E+00 0.0000000000E+00 ……………………………………………… Could anyone tell me the meaning of this file? And also,after x lapw2 -alm,the almblm file has a NUM which could show the number of eigenvalues as I see.I am confused since NUM is inconsistent with spaghetti_ene file which also gives the band-index as counter of eigenvalues.This situation is OK or could I do something wrong? Thank you.
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