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</o:shapelayout></xml><![endif]--></head><body lang=JA link=blue vlink=purple style='text-justify-trim:punctuation'><div class=WordSection1><p class=MsoNormal><span lang=EN-US style='font-size:10.0pt'>Dear WIEN2k users,<o:p></o:p></span></p><p class=MsoNormal><span lang=EN-US style='font-size:10.0pt'><o:p> </o:p></span></p><p class=MsoNormal><span lang=EN-US style='font-size:10.0pt'>An error occurs in x broadening of TELNES3 in WIEN2k_16.1.<o:p></o:p></span></p><p class=MsoNormal><span lang=EN-US style='font-size:10.0pt'>The details of the error are as follows.<o:p></o:p></span></p><p class=MsoNormal><span lang=EN-US style='font-size:10.0pt'><o:p> </o:p></span></p><p class=MsoNormal><span lang=EN-US style='font-size:10.0pt'> 0 lines 1014 lines<o:p></o:p></span></p><p class=MsoNormal><span lang=EN-US style='font-size:10.0pt'>forrtl: severe (59): list-directed I/O syntax error, unit 47, file /net/h86/WIEN2k/STO-test/STO-test.elnes<o:p></o:p></span></p><p class=MsoNormal><span lang=EN-US style='font-size:10.0pt'>Image PC Routine Line Source <o:p></o:p></span></p><p class=MsoNormal><span lang=EN-US style='font-size:10.0pt'>broadening 000000000042A94A Unknown Unknown Unknown<o:p></o:p></span></p><p class=MsoNormal><span lang=EN-US style='font-size:10.0pt'>broadening 0000000000428547 Unknown Unknown Unknown<o:p></o:p></span></p><p class=MsoNormal><span lang=EN-US style='font-size:10.0pt'>broadening 0000000000404B9B MAIN__ 201 broadening.f<o:p></o:p></span></p><p class=MsoNormal><span lang=EN-US style='font-size:10.0pt'>broadening 0000000000403156 Unknown Unknown Unknown<o:p></o:p></span></p><p class=MsoNormal><span lang=EN-US style='font-size:10.0pt'>libc.so.6 000000321B41ED1D Unknown Unknown Unknown<o:p></o:p></span></p><p class=MsoNormal><span lang=EN-US style='font-size:10.0pt'>broadening 0000000000403059 Unknown Unknown Unknown<o:p></o:p></span></p><p class=MsoNormal><span lang=EN-US style='font-size:10.0pt'>0.000u 0.012s 0:00.01 100.0% 0+0k 0+16io 0pf+0w<o:p></o:p></span></p><p class=MsoNormal><span lang=EN-US style='font-size:10.0pt'>error: command /net/h86/home/wien16/WIEN/broadening broadening.def failed<o:p></o:p></span></p><p class=MsoNormal><span lang=EN-US style='font-size:10.0pt'><o:p> </o:p></span></p><p class=MsoNormal><span lang=EN-US style='font-size:10.0pt'>The case.inb file is as follows.<o:p></o:p></span></p><p class=MsoNormal><span lang=EN-US style='font-size:10.0pt'><o:p> </o:p></span></p><p class=MsoNormal><span lang=EN-US style='font-size:10.0pt'>O-K edge of STO<o:p></o:p></span></p><p class=MsoNormal><span lang=EN-US style='font-size:10.0pt'>ELNES <o:p></o:p></span></p><p class=MsoNormal><span lang=EN-US style='font-size:10.0pt'>1 1 0<o:p></o:p></span></p><p class=MsoNormal><span lang=EN-US style='font-size:10.0pt'>0.0 1.0 0.0<o:p></o:p></span></p><p class=MsoNormal><span lang=EN-US style='font-size:10.0pt'>0.1558639190 0.1558639190<o:p></o:p></span></p><p class=MsoNormal><span lang=EN-US style='font-size:10.0pt'>1 0.0000000000<o:p></o:p></span></p><p class=MsoNormal><span lang=EN-US style='font-size:10.0pt'>0.1 <o:p></o:p></span></p><p class=MsoNormal><span lang=EN-US style='font-size:10.0pt'>dummy<o:p></o:p></span></p><p class=MsoNormal><span lang=EN-US style='font-size:10.0pt'>0.00<o:p></o:p></span></p><p class=MsoNormal><span lang=EN-US style='font-size:10.0pt'>0.000<o:p></o:p></span></p><p class=MsoNormal><span lang=EN-US style='font-size:10.0pt'>0.0<o:p></o:p></span></p><p class=MsoNormal><span lang=EN-US style='font-size:10.0pt'><o:p> </o:p></span></p><p class=MsoNormal><span lang=EN-US style='font-size:10.0pt'>Note that x telnes3 is executed successfully, and the ELNES spectrum of unbroaded appears in the plot.<o:p></o:p></span></p><p class=MsoNormal><span lang=EN-US style='font-size:10.0pt'>What causes an error?<o:p></o:p></span></p><p class=MsoNormal><span lang=EN-US style='font-size:10.0pt'>Thank you.<o:p></o:p></span></p><p class=MsoNormal><span lang=EN-US style='font-size:10.0pt'><o:p> </o:p></span></p><p class=MsoNormal><span lang=EN-US style='font-size:10.0pt'>A. Yamaguchi<o:p></o:p></span></p></div></body></html>