Respected Gavin Sorry for bothering again. In my Case folder there is no such file LDA.symmat1 or LDA.symmat2. By "touch"? you mean just click on the file ? There are similar 9 files which are LDA.symmat LDA.symmat_11
LDA.symmat_12 LDA.symmat_21 LDA.symmat_31 LDA.symmat_32 LDA.symmat_41 LDA.symmat_42 Best wishesMasood >________________________________ > From: Gavin Abo <gsabo at crimson.ua.edu> >To: A Mailing list for WIEN2k users <wien at zeus.theochem.tuwien.ac.at> >Sent: Tuesday, August 28, 2012 12:02 AM >Subject: Re: [Wien] Error in (x joint) calculating optical properties. > > >They should be created in your case folder, which seems to be called LDA. > >In the LDA folder in a terminal, > >touch LDA.symmat1 >touch LDA.symmat2? > >will create the blank files. > >However, the fixed x_lapw script (and opticpara_lapw script) in the thread are the recommended solution. > >On 8/27/2012 9:27 AM, Masood Yousaf wrote: > >Thank you Sir, >> >>Your attached Thread propose the fallowing solution. >> >>"You could create a blank "Fe.symmat1up" and rerun x joint for the time >>being" >> >>Would you explain how to creat this blank "Fe.symmat1"and where to put this ? >>I am new in this area so kindly eleborate it .?? >> >>Your's Affectionately >> >>Masood >> >> >> >>>________________________________ >>> From: Gavin Abo <gsabo at crimson.ua.edu> >>>To: A Mailing list for WIEN2k users <wien at zeus.theochem.tuwien.ac.at> >>>Sent: Monday, August 27, 2012 11:06 PM >>>Subject: Re: [Wien] Error in (x joint) calculating optical properties. >>> >>> >>>Use Wien2k 12.1 with the fixes or see: >>> >>>http://zeus.theochem.tuwien.ac.at/pipermail/wien/2012-July/017282.html >>> >>>On 8/27/2012 6:27 AM, Masood Yousaf wrote: >>> >>>Respected Wien2k Users, >>>> >>>>Kindly see this error message and suggest me some solution. I am using wien2k version 11 in Work station T7500 with 4 processors in parallel computation. >>>> >>>>'JOINT' -? can't open unit: 23?????????????????????????????????????????????? >>>>?'JOINT' -? filename: LDA.symmat1???????????????????????????????????????????? >>>>?'JOINT' -? status: OLD????????? form: FORMATTED?? >>>> >>>> >>>> >>>>Best wishes Masood >>>> >>>> >>>> >>>>_______________________________________________ Wien mailing list Wien at zeus.theochem.tuwien.ac.at http://zeus.theochem.tuwien.ac.at/mailman/listinfo/wien >>> >>>_______________________________________________ >>>Wien mailing list >>>Wien at zeus.theochem.tuwien.ac.at >>>http://zeus.theochem.tuwien.ac.at/mailman/listinfo/wien >>> >>> >>> >> >> >>_______________________________________________ Wien mailing list Wien at zeus.theochem.tuwien.ac.at http://zeus.theochem.tuwien.ac.at/mailman/listinfo/wien > >_______________________________________________ >Wien mailing list >Wien at zeus.theochem.tuwien.ac.at >http://zeus.theochem.tuwien.ac.at/mailman/listinfo/wien > > > -------------- next part -------------- An HTML attachment was scrubbed... URL: <http://zeus.theochem.tuwien.ac.at/pipermail/wien/attachments/20120827/db48b6b1/attachment.htm>