<html><body><div style="color:#000; background-color:#fff; font-family:times new roman, new york, times, serif;font-size:12pt"><div style="RIGHT: auto"><SPAN style="RIGHT: auto">Dear Prof P.Blaha and Users</SPAN></div>
<div style="RIGHT: auto"><SPAN style="RIGHT: auto">i again run one more iteration as you said me. i used k-parallel execution. </SPAN></div>
<div style="RIGHT: auto"><SPAN style="RIGHT: auto">but the again same problem occured again</SPAN></div>
<div style="RIGHT: auto"><SPAN style="RIGHT: auto"></SPAN> </div>
<div style="RIGHT: auto"><SPAN style="RIGHT: auto"><FONT color=#7f003f>running LAPW2 in parallel mode<BR>calculating QTL's from parallel vectors<BR>mv: cannot stat `super-sp.vectorup_1': No such file or directory<BR>mv: cannot stat `super-sp.vectorup_2': No such file or directory</FONT></SPAN></div>
<div style="RIGHT: auto"><SPAN style="RIGHT: auto"><FONT style="RIGHT: auto" color=#7f003f>L2main - Error<BR>0.464u 0.044s 0:00.59 84.7% 0+0k 0+1824io 0pf+0w</FONT></SPAN></div>
<div style="RIGHT: auto"><SPAN style="RIGHT: auto"><FONT color=#7f003f></FONT></SPAN> </div>
<div style="RIGHT: auto"><SPAN style="RIGHT: auto"><FONT style="RIGHT: auto" color=#000000>But the problem is this</FONT></SPAN></div>
<div style="RIGHT: auto"><SPAN style="RIGHT: auto"><FONT color=#7f003f></FONT></SPAN> </div>
<div style="RIGHT: auto"><STRONG style="RIGHT: auto"><FONT size=4><SPAN style="RIGHT: auto"><FONT style="RIGHT: auto" color=#000000>firstly, after scf i have these vector files </FONT></SPAN><SPAN style="RIGHT: auto"> </SPAN></FONT></STRONG></div>
<div style="RIGHT: auto"><SPAN style="RIGHT: auto"> </SPAN></div>
<div style="RIGHT: auto"><SPAN style="RIGHT: auto"><A style="RIGHT: auto" href="mailto:hashumi@spin4:~/WIEN2k/Fe2O3-sp/super-sp"><FONT color=#0000ff>hashumi@spin4:~/WIEN2k/Fe2O3-sp/super-sp</FONT></A><FONT style="RIGHT: auto" color=#0000ff>> ls -alsrt *vec*<BR> 0 -rw-r--r-- 1 hashumi users 0 2010-10-02 19:39 super-sp.vec<BR>888700 -rw-r--r-- 1 hashumi users 909133588 2010-10-10 03:30 super-sp.vectorup<BR>355392 -rw-r--r-- 1 hashumi users 363560875 2010-10-10 04:08 super-sp.vectordn<BR> 50700 -rw-r--r-- 1 hashumi users 51856189 2010-10-10 04:38 super-sp.vectorup_3<BR> 51168 -rw-r--r-- 1 hashumi users 52338337 2010-10-10 04:38 super-sp.vectorup_2<BR> 50304 -rw-r--r-- 1 hashumi users 51451533 2010-10-10 04:38 super-sp.vectorup_6<BR> 50468 -rw-r--r-- 1 hashumi users 51618481 2010-10-10 04:38 super-sp.vectorup_4<BR> 51548 -rw-r--r-- 1
hashumi users 52725825 2010-10-10 04:38 super-sp.vectorup_1<BR> 50136 -rw-r--r-- 1 hashumi users 51278405 2010-10-10 04:39 super-sp.vectorup_14<BR> 50380 -rw-r--r-- 1 hashumi users 51530425 2010-10-10 04:39 super-sp.vectorup_10<BR> 50560 -rw-r--r-- 1 hashumi users 51713165 2010-10-10 04:39 super-sp.vectorup_12<BR> 50220 -rw-r--r-- 1 hashumi users 51365593 2010-10-10 04:39 super-sp.vectorup_15<BR> 50488 -rw-r--r-- 1 hashumi users 51639889 2010-10-10 04:39 super-sp.vectorup_5<BR> 50048 -rw-r--r-- 1 hashumi users 51188773 2010-10-10 04:39 super-sp.vectorup_16<BR> 50492 -rw-r--r-- 1 hashumi users 51643613 2010-10-10 04:39 super-sp.vectorup_9<BR> 50944 -rw-r--r-- 1 hashumi users 52105309 2010-10-10 04:39 super-sp.vectorup_7<BR> 50688 -rw-r--r-- 1 hashumi users 51844201 2010-10-10 04:39 super-sp.vectorup_8<BR> 50388 -rw-r--r-- 1 hashumi users
51538417 2010-10-10 04:39 super-sp.vectorup_13<BR> 50428 -rw-r--r-- 1 hashumi users 51579165 2010-10-10 04:39 super-sp.vectorup_11<BR> 10024 -rw-r--r-- 1 hashumi users 10245085 2010-10-10 04:40 super-sp.vectorup_20<BR> 9988 -rw-r--r-- 1 hashumi users 10207869 2010-10-10 04:40 super-sp.vectorup_18<BR> 10040 -rw-r--r-- 1 hashumi users 10261005 2010-10-10 04:40 super-sp.vectorup_17<BR> 10056 -rw-r--r-- 1 hashumi users 10276925 2010-10-10 04:40 super-sp.vectorup_21<BR> 9984 -rw-r--r-- 1 hashumi users 10203905 2010-10-10 04:40 super-sp.vectorup_19<BR> 10000 -rw-r--r-- 1 hashumi users 10219761 2010-10-10 04:40 super-sp.vectorup_22<BR> 10036 -rw-r--r-- 1 hashumi users 10257025 2010-10-10 04:40 super-sp.vectorup_23<BR> 10024 -rw-r--r-- 1 hashumi users 10245085 2010-10-10 04:40 super-sp.vectorup_24<BR> 51168 -rw-r--r-- 1 hashumi users 52338337
2010-10-10 04:51 super-sp.vectordn_2<BR> 50700 -rw-r--r-- 1 hashumi users 51856189 2010-10-10 04:51 super-sp.vectordn_3<BR> 51548 -rw-r--r-- 1 hashumi users 52725825 2010-10-10 04:51 super-sp.vectordn_1<BR> 50944 -rw-r--r-- 1 hashumi users 52105309 2010-10-10 04:51 super-sp.vectordn_7<BR> 50380 -rw-r--r-- 1 hashumi users 51530425 2010-10-10 04:51 super-sp.vectordn_10<BR> 50468 -rw-r--r-- 1 hashumi users 51618481 2010-10-10 04:51 super-sp.vectordn_4<BR> 50688 -rw-r--r-- 1 hashumi users 51844201 2010-10-10 04:51 super-sp.vectordn_8<BR> 50388 -rw-r--r-- 1 hashumi users 51538417 2010-10-10 04:51 super-sp.vectordn_13<BR> 50492 -rw-r--r-- 1 hashumi users 51643613 2010-10-10 04:51 super-sp.vectordn_9<BR> 50136 -rw-r--r-- 1 hashumi users 51278405 2010-10-10 04:51 super-sp.vectordn_14<BR> 50560 -rw-r--r-- 1 hashumi users 51713165 2010-10-10 04:51
super-sp.vectordn_12<BR> 50428 -rw-r--r-- 1 hashumi users 51579165 2010-10-10 04:51 super-sp.vectordn_11<BR> 50488 -rw-r--r-- 1 hashumi users 51639889 2010-10-10 04:51 super-sp.vectordn_5<BR> 50048 -rw-r--r-- 1 hashumi users 51188773 2010-10-10 04:51 super-sp.vectordn_16<BR> 50220 -rw-r--r-- 1 hashumi users 51365593 2010-10-10 04:51 super-sp.vectordn_15<BR> 50304 -rw-r--r-- 1 hashumi users 51451533 2010-10-10 04:51 super-sp.vectordn_6<BR> 10040 -rw-r--r-- 1 hashumi users 10261005 2010-10-10 04:52 super-sp.vectordn_17<BR> 9988 -rw-r--r-- 1 hashumi users 10207869 2010-10-10 04:52 super-sp.vectordn_18<BR> 9984 -rw-r--r-- 1 hashumi users 10203905 2010-10-10 04:52 super-sp.vectordn_19<BR> 10024 -rw-r--r-- 1 hashumi users 10245085 2010-10-10 04:52 super-sp.vectordn_20<BR> 10056 -rw-r--r-- 1 hashumi users 10276925 2010-10-10 04:52
super-sp.vectordn_21<BR> 10000 -rw-r--r-- 1 hashumi users 10219761 2010-10-10 04:52 super-sp.vectordn_22<BR> 10024 -rw-r--r-- 1 hashumi users 10245085 2010-10-10 04:52 super-sp.vectordn_24<BR> 10036 -rw-r--r-- 1 hashumi users 10257025 2010-10-10 04:52 super-sp.vectordn_23<BR></FONT></SPAN><SPAN style="RIGHT: auto"></SPAN></div>
<div style="RIGHT: auto"><SPAN style="RIGHT: auto">when i calculate DOS, click on x lapw2 -p -up -qtl, after this all up files change into <FONT size=4><STRONG>old files,</STRONG> <FONT size=3>and after that i have these files</FONT></FONT></SPAN><SPAN style="RIGHT: auto"></SPAN></div>
<div style="RIGHT: auto"><SPAN style="RIGHT: auto"></SPAN> </div>
<div style="RIGHT: auto"><SPAN style="RIGHT: auto"><A style="RIGHT: auto" href="mailto:hashumi@spin4:~/WIEN2k/Fe2O3-sp/super-sp"><FONT color=#0000ff>hashumi@spin4:~/WIEN2k/Fe2O3-sp/super-sp</FONT></A><FONT style="RIGHT: auto" color=#0000ff>> ls -alsrt *vec*<BR> 0 -rw-r--r-- 1 hashumi users 0 2010-10-02 19:39 super-sp.vec<BR>888700 -rw-r--r-- 1 hashumi users 909133588 2010-10-10 03:30 super-sp.vectorup<BR>355392 -rw-r--r-- 1 hashumi users 363560875 2010-10-10 04:08 super-sp.vectordn<BR> 50700 -rw-r--r-- 1 hashumi users 51856189 2010-10-10 04:38 super-sp.vectorup_3.old<BR> 51168 -rw-r--r-- 1 hashumi users 52338337 2010-10-10 04:38 super-sp.vectorup_2.old<BR> 50304 -rw-r--r-- 1 hashumi users 51451533 2010-10-10 04:38 super-sp.vectorup_6.old<BR> 50468 -rw-r--r-- 1 hashumi users 51618481 2010-10-10 04:38 super-sp.vectorup_4.old<BR> 51548
-rw-r--r-- 1 hashumi users 52725825 2010-10-10 04:38 super-sp.vectorup_1.old<BR> 50136 -rw-r--r-- 1 hashumi users 51278405 2010-10-10 04:39 super-sp.vectorup_14.old<BR> 50380 -rw-r--r-- 1 hashumi users 51530425 2010-10-10 04:39 super-sp.vectorup_10.old<BR> 50560 -rw-r--r-- 1 hashumi users 51713165 2010-10-10 04:39 super-sp.vectorup_12.old<BR> 50220 -rw-r--r-- 1 hashumi users 51365593 2010-10-10 04:39 super-sp.vectorup_15.old<BR> 50488 -rw-r--r-- 1 hashumi users 51639889 2010-10-10 04:39 super-sp.vectorup_5.old<BR> 50048 -rw-r--r-- 1 hashumi us<VAR id=yui-ie-cursor></VAR>ers 51188773 2010-10-10 04:39 super-sp.vectorup_16.old<BR> 50492 -rw-r--r-- 1 hashumi users 51643613 2010-10-10 04:39 super-sp.vectorup_9.old<BR> 50944 -rw-r--r-- 1 hashumi users 52105309 2010-10-10 04:39 super-sp.vectorup_7.old<BR> 50688 -rw-r--r-- 1 hashumi users 51844201 2010-10-10
04:39 super-sp.vectorup_8.old<BR> 50388 -rw-r--r-- 1 hashumi users 51538417 2010-10-10 04:39 super-sp.vectorup_13.old<BR> 50428 -rw-r--r-- 1 hashumi users 51579165 2010-10-10 04:39 super-sp.vectorup_11.old<BR> 10024 -rw-r--r-- 1 hashumi users 10245085 2010-10-10 04:40 super-sp.vectorup_20.old<BR> 9988 -rw-r--r-- 1 hashumi users 10207869 2010-10-10 04:40 super-sp.vectorup_18.old<BR> 10040 -rw-r--r-- 1 hashumi users 10261005 2010-10-10 04:40 super-sp.vectorup_17.old<BR> 10056 -rw-r--r-- 1 hashumi users 10276925 2010-10-10 04:40 super-sp.vectorup_21.old<BR> 9984 -rw-r--r-- 1 hashumi users 10203905 2010-10-10 04:40 super-sp.vectorup_19.old<BR> 10000 -rw-r--r-- 1 hashumi users 10219761 2010-10-10 04:40 super-sp.vectorup_22.old<BR> 10036 -rw-r--r-- 1 hashumi users 10257025 2010-10-10 04:40 super-sp.vectorup_23.old<BR> 10024 -rw-r--r-- 1 hashumi
users 10245085 2010-10-10 04:40 super-sp.vectorup_24.old<BR> 51168 -rw-r--r-- 1 hashumi users 52338337 2010-10-10 04:51 super-sp.vectordn_2<BR> 50700 -rw-r--r-- 1 hashumi users 51856189 2010-10-10 04:51 super-sp.vectordn_3<BR> 51548 -rw-r--r-- 1 hashumi users 52725825 2010-10-10 04:51 super-sp.vectordn_1<BR> 50944 -rw-r--r-- 1 hashumi users 52105309 2010-10-10 04:51 super-sp.vectordn_7<BR> 50380 -rw-r--r-- 1 hashumi users 51530425 2010-10-10 04:51 super-sp.vectordn_10<BR> 50468 -rw-r--r-- 1 hashumi users 51618481 2010-10-10 04:51 super-sp.vectordn_4<BR> 50688 -rw-r--r-- 1 hashumi users 51844201 2010-10-10 04:51 super-sp.vectordn_8<BR> 50388 -rw-r--r-- 1 hashumi users 51538417 2010-10-10 04:51 super-sp.vectordn_13<BR> 50492 -rw-r--r-- 1 hashumi users 51643613 2010-10-10 04:51 super-sp.vectordn_9<BR> 50136 -rw-r--r-- 1 hashumi users 51278405
2010-10-10 04:51 super-sp.vectordn_14<BR> 50560 -rw-r--r-- 1 hashumi users 51713165 2010-10-10 04:51 super-sp.vectordn_12<BR> 50428 -rw-r--r-- 1 hashumi users 51579165 2010-10-10 04:51 super-sp.vectordn_11<BR> 50488 -rw-r--r-- 1 hashumi users 51639889 2010-10-10 04:51 super-sp.vectordn_5<BR> 50048 -rw-r--r-- 1 hashumi users 51188773 2010-10-10 04:51 super-sp.vectordn_16<BR> 50220 -rw-r--r-- 1 hashumi users 51365593 2010-10-10 04:51 super-sp.vectordn_15<BR> 50304 -rw-r--r-- 1 hashumi users 51451533 2010-10-10 04:51 super-sp.vectordn_6<BR> 10040 -rw-r--r-- 1 hashumi users 10261005 2010-10-10 04:52 super-sp.vectordn_17<BR> 9988 -rw-r--r-- 1 hashumi users 10207869 2010-10-10 04:52 super-sp.vectordn_18<BR> 9984 -rw-r--r-- 1 hashumi users 10203905 2010-10-10 04:52 super-sp.vectordn_19<BR> 10024 -rw-r--r-- 1 hashumi users 10245085 2010-10-10 04:52
super-sp.vectordn_20<BR> 10056 -rw-r--r-- 1 hashumi users 10276925 2010-10-10 04:52 super-sp.vectordn_21<BR> 10000 -rw-r--r-- 1 hashumi users 10219761 2010-10-10 04:52 super-sp.vectordn_22<BR> 10024 -rw-r--r-- 1 hashumi users 10245085 2010-10-10 04:52 super-sp.vectordn_24<BR> 10036 -rw-r--r-- 1 hashumi users 10257025 2010-10-10 04:52 super-sp.vectordn_23<BR> 0 -rw-r--r-- 1 hashumi users 0 2010-10-10 06:13 super-sp.vectorsoup</FONT></SPAN></div>
<div style="RIGHT: auto"><SPAN style="RIGHT: auto"><FONT style="RIGHT: auto" color=#0000ff></FONT></SPAN> </div>
<div style="RIGHT: auto"><SPAN style="RIGHT: auto"><FONT style="RIGHT: auto" color=#000000>Please all give your kind concentration and kindly tell me how can i solve this matter. i will be very grateful to you.</FONT></SPAN></div>
<div style="RIGHT: auto"><SPAN style="RIGHT: auto"><FONT style="RIGHT: auto" color=#000000></FONT></SPAN> </div>
<div style="RIGHT: auto"><SPAN style="RIGHT: auto"><FONT style="RIGHT: auto" color=#000000>Thanks and Regards</FONT></SPAN></div>
<div style="RIGHT: auto"><SPAN style="RIGHT: auto"><FONT style="RIGHT: auto"><FONT color=#000000>Arqum Hashmi</FONT></div></FONT></SPAN>
<div><BR></div>
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<DIV style="FONT-FAMILY: times new roman, new york, times, serif; FONT-SIZE: 12pt">
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<DIV style="BORDER-BOTTOM: #ccc 1px solid; BORDER-LEFT: #ccc 1px solid; PADDING-BOTTOM: 0px; LINE-HEIGHT: 0; MARGIN: 5px 0px; PADDING-LEFT: 0px; PADDING-RIGHT: 0px; HEIGHT: 0px; FONT-SIZE: 0px; BORDER-TOP: #ccc 1px solid; BORDER-RIGHT: #ccc 1px solid; PADDING-TOP: 0px" class=hr contentEditable=false readonly="true"></DIV><B><SPAN style="FONT-WEIGHT: bold">From:</SPAN></B> Peter Blaha <pblaha@theochem.tuwien.ac.at><BR><B><SPAN style="FONT-WEIGHT: bold">To:</SPAN></B> A Mailing list for WIEN2k users <wien@zeus.theochem.tuwien.ac.at> <BR><B><SPAN style="FONT-WEIGHT: bold">Sent:</SPAN></B> Wednesday, February 15, 2012 4:24 AM<BR><B><SPAN style="FONT-WEIGHT: bold">Subject:</SPAN></B> Re: [Wien] plz help<BR></FONT></DIV><BR>So everything is clear: You need super-sp.vectorup/dn, but you have <BR>only super-sp.vectorup_old.<BR><BR>Since the date of your computer shows 2010 ?? I cannot judge if the <BR>vector_old files are recent or not.<BR>They
are created during run_lapw -it ,<BR>but usually just before the lapw1 step.<BR><BR>Eventually you can use old2vec, but as I said, I've no idea if these <BR>vector files are ok.<BR><BR>Otherwise run one more iteration.....<BR><BR>> The super-sp.vec, super-sp.vectorup, super-sp.vectordn files are zero<BR>> but the super-sp.vectorup_2.old, super-sp.vectorup_1.old,<BR>> super-sp.vectordn_2.old, super-sp.vectordn_1.old are present and non-zero.<BR>><BR>> the out put of ls -alsrt *vec* is<BR>><BR>> 0 -rw-r--r-- 1 hashumi users 0 2010-10-02 19:39 super-sp.vec<BR>> 0 -rw-r--r-- 1 hashumi users 0 2010-10-02 21:15 super-sp.vectorup<BR>> 0 -rw-r--r-- 1 hashumi users 0 2010-10-02 21:19 super-sp.vectordn<BR>> 442356 -rw-r--r-- 1 hashumi users 452522104 2010-10-05 12:53<BR>> super-sp.vectorup_2.old<BR>> 446596 -rw-r--r-- 1 hashumi users 456859756 2010-10-05 12:53<BR>> super-sp.vectorup_1.old<BR>> 442356
-rw-r--r-- 1 hashumi users 452522104 2010-10-05 13:41<BR>> super-sp.vectordn_2.old<BR>> 446596 -rw-r--r-- 1 hashumi users 456859756 2010-10-05 13:41<BR>> super-sp.vectordn_1.old<BR>><BR>> Kindly tell me what can i do to solve this problem.<BR>><BR>> i will be very grateful to you.<BR>><BR>> Thanks and Regrads<BR>> Arqum Hashmi<BR>><BR>> ------------------------------------------------------------------------<BR>> *From:* Peter Blaha <<A href="mailto:pblaha@theochem.tuwien.ac.at" ymailto="mailto:pblaha@theochem.tuwien.ac.at">pblaha@theochem.tuwien.ac.at</A>><BR>> *To:* A Mailing list for WIEN2k users <<A href="mailto:wien@zeus.theochem.tuwien.ac.at" ymailto="mailto:wien@zeus.theochem.tuwien.ac.at">wien@zeus.theochem.tuwien.ac.at</A>><BR>> *Sent:* Tuesday, February 14, 2012 4:17 AM<BR>> *Subject:* Re: [Wien] plz help<BR>><BR>> cat uplapw2.def<BR>><BR>> Is there a $SCRATCH defined
?<BR>><BR>> ls -alsrt *vec* are the vector files: new, non-zero,... ?<BR>><BR>> Am 14.02.2012 12:53, schrieb arqum hashmi:<BR>> > Dear Users<BR>> > i am calculating the AFM Fe2O3. i run spin polarized and parallel<BR>> > calculation. after Scf caclulation.<BR>> > when i calculate DOS, click on *x lapw2 -p -up -qtl<BR>> > *<BR>> > *i t gives this error*<BR>> ><BR>> > running LAPW2 in parallel mode<BR>> > calculating QTL's from parallel vectors<BR>> > mv: cannot stat `super-sp.vectorup_1': No such file or directory<BR>> > mv: cannot stat `super-sp.vectorup_2': No such file or directory<BR>> > L2main - Error<BR>> > 0.436u 0.048s 0:00.54 87.0% 0+0k 0+1864io 0pf+0w<BR>> ><BR>> > what is this error although these two files are present there.when i<BR>> > see
error file /home/hashumi/WIEN2k/Fe2O3-sp/super-sp/uplapw2.error<BR>> > it gives this<BR>> ><BR>> > Error in LAPW2<BR>> > 'l2main' - error reading parallel vectors<BR>> ><BR>> ><BR>> > Please guide me why this error occured and how can i solve it.<BR>> ><BR>> > i will be very grateful to you.<BR>> ><BR>> > Thanks and Regards<BR>> > Arqum Hashmi<BR>> ><BR>> ><BR>> ><BR>> ><BR>> > _______________________________________________<BR>> > Wien mailing list<BR>> > <A href="mailto:Wien@zeus.theochem.tuwien.ac.at" ymailto="mailto:Wien@zeus.theochem.tuwien.ac.at">Wien@zeus.theochem.tuwien.ac.at</A> <mailto:<A href="mailto:Wien@zeus.theochem.tuwien.ac.at"
ymailto="mailto:Wien@zeus.theochem.tuwien.ac.at">Wien@zeus.theochem.tuwien.ac.at</A>><BR>> > http://zeus.theochem.tuwien.ac.at/mailman/listinfo/wien<BR>><BR>> --<BR>> Peter Blaha<BR>> Inst.Materials Chemistry<BR>> TU Vienna<BR>> Getreidemarkt 9<BR>> A-1060 Vienna<BR>> Austria<BR>> +43-1-5880115671<BR>> _______________________________________________<BR>> Wien mailing list<BR>> <A href="mailto:Wien@zeus.theochem.tuwien.ac.at" ymailto="mailto:Wien@zeus.theochem.tuwien.ac.at">Wien@zeus.theochem.tuwien.ac.at</A> <mailto:<A href="mailto:Wien@zeus.theochem.tuwien.ac.at" ymailto="mailto:Wien@zeus.theochem.tuwien.ac.at">Wien@zeus.theochem.tuwien.ac.at</A>><BR>> <A href="http://zeus.theochem.tuwien.ac.at/mailman/listinfo/wien" target=_blank>http://zeus.theochem.tuwien.ac.at/mailman/listinfo/wien</A><BR>><BR>><BR>><BR>><BR>> _______________________________________________<BR>> Wien
mailing list<BR>> <A href="mailto:Wien@zeus.theochem.tuwien.ac.at" ymailto="mailto:Wien@zeus.theochem.tuwien.ac.at">Wien@zeus.theochem.tuwien.ac.at</A><BR>> <A href="http://zeus.theochem.tuwien.ac.at/mailman/listinfo/wien" target=_blank>http://zeus.theochem.tuwien.ac.at/mailman/listinfo/wien</A><BR><BR>-- <BR>Peter Blaha<BR>Inst.Materials Chemistry<BR>TU Vienna<BR>Getreidemarkt 9<BR>A-1060 Vienna<BR>Austria<BR>+43-1-5880115671<BR>_______________________________________________<BR>Wien mailing list<BR><A href="mailto:Wien@zeus.theochem.tuwien.ac.at" ymailto="mailto:Wien@zeus.theochem.tuwien.ac.at">Wien@zeus.theochem.tuwien.ac.at</A><BR><A href="http://zeus.theochem.tuwien.ac.at/mailman/listinfo/wien" target=_blank>http://zeus.theochem.tuwien.ac.at/mailman/listinfo/wien</A><BR><BR><BR></DIV></DIV></div></body></html>