<html><body><div style="color:#000; background-color:#fff; font-family:times new roman, new york, times, serif;font-size:12pt"><div><span>Wien2k_10<br></span></div><div><br></div> <div style="font-family: times new roman, new york, times, serif; font-size: 12pt;"> <div style="font-family: times new roman, new york, times, serif; font-size: 12pt;"> <div dir="ltr"> <font face="Arial" size="2"> <hr size="1"> <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> Thursday, February 16, 2012 8:59 AM<br> <b><span style="font-weight: bold;">Subject:</span></b> Re: [Wien] plz help<br> </font> </div> <br>
Which WIEN2k version are you using ?<br><br>It seems to be a problem with either lapw2para or vec2old, which does <br>not take the -local switch properly.<br><br>> i again run one more iteration as you said me. i used k-parallel execution.<br>> but the again same problem occured again<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>> 0.464u 0.044s 0:00.59 84.7% 0+0k 0+1824io 0pf+0w<br>> But the problem is this<br>> *firstly, after scf i have these vector files *<br>> hashumi@spin4:~/WIEN2k/Fe2O3-sp/super-sp<br>> <mailto:hashumi@spin4:~/WIEN2k/Fe2O3-sp/super-sp>> 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<br>> super-sp.vectorup<br>> 355392 -rw-r--r-- 1 hashumi users 363560875 2010-10-10 04:08<br>> super-sp.vectordn<br>> 50700 -rw-r--r-- 1 hashumi users 51856189 2010-10-10 04:38<br>> super-sp.vectorup_3<br>> 51168 -rw-r--r-- 1 hashumi users 52338337 2010-10-10 04:38<br>> super-sp.vectorup_2<br>> 50304 -rw-r--r-- 1 hashumi users 51451533 2010-10-10 04:38<br>> super-sp.vectorup_6<br>> 50468 -rw-r--r-- 1 hashumi users 51618481 2010-10-10 04:38<br>> super-sp.vectorup_4<br>> 51548 -rw-r--r-- 1 hashumi users 52725825 2010-10-10 04:38<br>> super-sp.vectorup_1<br>> 50136 -rw-r--r-- 1 hashumi users 51278405 2010-10-10 04:39<br>> super-sp.vectorup_14<br>> 50380 -rw-r--r-- 1 hashumi users 51530425 2010-10-10 04:39<br>> super-sp.vectorup_10<br>> 50560 -rw-r--r-- 1 hashumi users 51713165 2010-10-10 04:39<br>> super-sp.vectorup_12<br>> 50220 -rw-r--r-- 1 hashumi users 51365593 2010-10-10
04:39<br>> super-sp.vectorup_15<br>> 50488 -rw-r--r-- 1 hashumi users 51639889 2010-10-10 04:39<br>> super-sp.vectorup_5<br>> 50048 -rw-r--r-- 1 hashumi users 51188773 2010-10-10 04:39<br>> super-sp.vectorup_16<br>> 50492 -rw-r--r-- 1 hashumi users 51643613 2010-10-10 04:39<br>> super-sp.vectorup_9<br>> 50944 -rw-r--r-- 1 hashumi users 52105309 2010-10-10 04:39<br>> super-sp.vectorup_7<br>> 50688 -rw-r--r-- 1 hashumi users 51844201 2010-10-10 04:39<br>> super-sp.vectorup_8<br>> 50388 -rw-r--r-- 1 hashumi users 51538417 2010-10-10 04:39<br>> super-sp.vectorup_13<br>> 50428 -rw-r--r-- 1 hashumi users 51579165 2010-10-10 04:39<br>> super-sp.vectorup_11<br>> 10024 -rw-r--r-- 1 hashumi users 10245085 2010-10-10 04:40<br>> super-sp.vectorup_20<br>> 9988 -rw-r--r-- 1 hashumi users 10207869 2010-10-10 04:40<br>> super-sp.vectorup_18<br>> 10040 -rw-r--r-- 1 hashumi users 10261005 2010-10-10
04:40<br>> super-sp.vectorup_17<br>> 10056 -rw-r--r-- 1 hashumi users 10276925 2010-10-10 04:40<br>> super-sp.vectorup_21<br>> 9984 -rw-r--r-- 1 hashumi users 10203905 2010-10-10 04:40<br>> super-sp.vectorup_19<br>> 10000 -rw-r--r-- 1 hashumi users 10219761 2010-10-10 04:40<br>> super-sp.vectorup_22<br>> 10036 -rw-r--r-- 1 hashumi users 10257025 2010-10-10 04:40<br>> super-sp.vectorup_23<br>> 10024 -rw-r--r-- 1 hashumi users 10245085 2010-10-10 04:40<br>> super-sp.vectorup_24<br>> 51168 -rw-r--r-- 1 hashumi users 52338337 2010-10-10 04:51<br>> super-sp.vectordn_2<br>> 50700 -rw-r--r-- 1 hashumi users 51856189 2010-10-10 04:51<br>> super-sp.vectordn_3<br>> 51548 -rw-r--r-- 1 hashumi users 52725825 2010-10-10 04:51<br>> super-sp.vectordn_1<br>> 50944 -rw-r--r-- 1 hashumi users 52105309 2010-10-10 04:51<br>> super-sp.vectordn_7<br>> 50380 -rw-r--r-- 1 hashumi users 51530425 2010-10-10
04:51<br>> super-sp.vectordn_10<br>> 50468 -rw-r--r-- 1 hashumi users 51618481 2010-10-10 04:51<br>> super-sp.vectordn_4<br>> 50688 -rw-r--r-- 1 hashumi users 51844201 2010-10-10 04:51<br>> super-sp.vectordn_8<br>> 50388 -rw-r--r-- 1 hashumi users 51538417 2010-10-10 04:51<br>> super-sp.vectordn_13<br>> 50492 -rw-r--r-- 1 hashumi users 51643613 2010-10-10 04:51<br>> super-sp.vectordn_9<br>> 50136 -rw-r--r-- 1 hashumi users 51278405 2010-10-10 04:51<br>> super-sp.vectordn_14<br>> 50560 -rw-r--r-- 1 hashumi users 51713165 2010-10-10 04:51<br>> super-sp.vectordn_12<br>> 50428 -rw-r--r-- 1 hashumi users 51579165 2010-10-10 04:51<br>> super-sp.vectordn_11<br>> 50488 -rw-r--r-- 1 hashumi users 51639889 2010-10-10 04:51<br>> super-sp.vectordn_5<br>> 50048 -rw-r--r-- 1 hashumi users 51188773 2010-10-10 04:51<br>> super-sp.vectordn_16<br>> 50220 -rw-r--r-- 1 hashumi users 51365593 2010-10-10
04:51<br>> super-sp.vectordn_15<br>> 50304 -rw-r--r-- 1 hashumi users 51451533 2010-10-10 04:51<br>> super-sp.vectordn_6<br>> 10040 -rw-r--r-- 1 hashumi users 10261005 2010-10-10 04:52<br>> super-sp.vectordn_17<br>> 9988 -rw-r--r-- 1 hashumi users 10207869 2010-10-10 04:52<br>> super-sp.vectordn_18<br>> 9984 -rw-r--r-- 1 hashumi users 10203905 2010-10-10 04:52<br>> super-sp.vectordn_19<br>> 10024 -rw-r--r-- 1 hashumi users 10245085 2010-10-10 04:52<br>> super-sp.vectordn_20<br>> 10056 -rw-r--r-- 1 hashumi users 10276925 2010-10-10 04:52<br>> super-sp.vectordn_21<br>> 10000 -rw-r--r-- 1 hashumi users 10219761 2010-10-10 04:52<br>> super-sp.vectordn_22<br>> 10024 -rw-r--r-- 1 hashumi users 10245085 2010-10-10 04:52<br>> super-sp.vectordn_24<br>> 10036 -rw-r--r-- 1 hashumi users 10257025 2010-10-10 04:52<br>> super-sp.vectordn_23<br>> when i calculate DOS, click on x lapw2 -p -up -qtl, after this
all up<br>> files change into *old files,* and after that i have these files<br>> hashumi@spin4:~/WIEN2k/Fe2O3-sp/super-sp<br>> <mailto:hashumi@spin4:~/WIEN2k/Fe2O3-sp/super-sp>> 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<br>> super-sp.vectorup<br>> 355392 -rw-r--r-- 1 hashumi users 363560875 2010-10-10 04:08<br>> super-sp.vectordn<br>> 50700 -rw-r--r-- 1 hashumi users 51856189 2010-10-10 04:38<br>> super-sp.vectorup_3.old<br>> 51168 -rw-r--r-- 1 hashumi users 52338337 2010-10-10 04:38<br>> super-sp.vectorup_2.old<br>> 50304 -rw-r--r-- 1 hashumi users 51451533 2010-10-10 04:38<br>> super-sp.vectorup_6.old<br>> 50468 -rw-r--r-- 1 hashumi users 51618481 2010-10-10 04:38<br>> super-sp.vectorup_4.old<br>> 51548 -rw-r--r-- 1 hashumi users 52725825 2010-10-10 04:38<br>>
super-sp.vectorup_1.old<br>> 50136 -rw-r--r-- 1 hashumi users 51278405 2010-10-10 04:39<br>> super-sp.vectorup_14.old<br>> 50380 -rw-r--r-- 1 hashumi users 51530425 2010-10-10 04:39<br>> super-sp.vectorup_10.old<br>> 50560 -rw-r--r-- 1 hashumi users 51713165 2010-10-10 04:39<br>> super-sp.vectorup_12.old<br>> 50220 -rw-r--r-- 1 hashumi users 51365593 2010-10-10 04:39<br>> super-sp.vectorup_15.old<br>> 50488 -rw-r--r-- 1 hashumi users 51639889 2010-10-10 04:39<br>> super-sp.vectorup_5.old<br>> 50048 -rw-r--r-- 1 hashumi users 51188773 2010-10-10 04:39<br>> super-sp.vectorup_16.old<br>> 50492 -rw-r--r-- 1 hashumi users 51643613 2010-10-10 04:39<br>> super-sp.vectorup_9.old<br>> 50944 -rw-r--r-- 1 hashumi users 52105309 2010-10-10 04:39<br>> super-sp.vectorup_7.old<br>> 50688 -rw-r--r-- 1 hashumi users 51844201 2010-10-10 04:39<br>> super-sp.vectorup_8.old<br>> 50388 -rw-r--r-- 1 hashumi users
51538417 2010-10-10 04:39<br>> super-sp.vectorup_13.old<br>> 50428 -rw-r--r-- 1 hashumi users 51579165 2010-10-10 04:39<br>> super-sp.vectorup_11.old<br>> 10024 -rw-r--r-- 1 hashumi users 10245085 2010-10-10 04:40<br>> super-sp.vectorup_20.old<br>> 9988 -rw-r--r-- 1 hashumi users 10207869 2010-10-10 04:40<br>> super-sp.vectorup_18.old<br>> 10040 -rw-r--r-- 1 hashumi users 10261005 2010-10-10 04:40<br>> super-sp.vectorup_17.old<br>> 10056 -rw-r--r-- 1 hashumi users 10276925 2010-10-10 04:40<br>> super-sp.vectorup_21.old<br>> 9984 -rw-r--r-- 1 hashumi users 10203905 2010-10-10 04:40<br>> super-sp.vectorup_19.old<br>> 10000 -rw-r--r-- 1 hashumi users 10219761 2010-10-10 04:40<br>> super-sp.vectorup_22.old<br>> 10036 -rw-r--r-- 1 hashumi users 10257025 2010-10-10 04:40<br>> super-sp.vectorup_23.old<br>> 10024 -rw-r--r-- 1 hashumi users 10245085 2010-10-10 04:40<br>> super-sp.vectorup_24.old<br>>
51168 -rw-r--r-- 1 hashumi users 52338337 2010-10-10 04:51<br>> super-sp.vectordn_2<br>> 50700 -rw-r--r-- 1 hashumi users 51856189 2010-10-10 04:51<br>> super-sp.vectordn_3<br>> 51548 -rw-r--r-- 1 hashumi users 52725825 2010-10-10 04:51<br>> super-sp.vectordn_1<br>> 50944 -rw-r--r-- 1 hashumi users 52105309 2010-10-10 04:51<br>> super-sp.vectordn_7<br>> 50380 -rw-r--r-- 1 hashumi users 51530425 2010-10-10 04:51<br>> super-sp.vectordn_10<br>> 50468 -rw-r--r-- 1 hashumi users 51618481 2010-10-10 04:51<br>> super-sp.vectordn_4<br>> 50688 -rw-r--r-- 1 hashumi users 51844201 2010-10-10 04:51<br>> super-sp.vectordn_8<br>> 50388 -rw-r--r-- 1 hashumi users 51538417 2010-10-10 04:51<br>> super-sp.vectordn_13<br>> 50492 -rw-r--r-- 1 hashumi users 51643613 2010-10-10 04:51<br>> super-sp.vectordn_9<br>> 50136 -rw-r--r-- 1 hashumi users 51278405 2010-10-10 04:51<br>> super-sp.vectordn_14<br>> 50560
-rw-r--r-- 1 hashumi users 51713165 2010-10-10 04:51<br>> super-sp.vectordn_12<br>> 50428 -rw-r--r-- 1 hashumi users 51579165 2010-10-10 04:51<br>> super-sp.vectordn_11<br>> 50488 -rw-r--r-- 1 hashumi users 51639889 2010-10-10 04:51<br>> super-sp.vectordn_5<br>> 50048 -rw-r--r-- 1 hashumi users 51188773 2010-10-10 04:51<br>> super-sp.vectordn_16<br>> 50220 -rw-r--r-- 1 hashumi users 51365593 2010-10-10 04:51<br>> super-sp.vectordn_15<br>> 50304 -rw-r--r-- 1 hashumi users 51451533 2010-10-10 04:51<br>> super-sp.vectordn_6<br>> 10040 -rw-r--r-- 1 hashumi users 10261005 2010-10-10 04:52<br>> super-sp.vectordn_17<br>> 9988 -rw-r--r-- 1 hashumi users 10207869 2010-10-10 04:52<br>> super-sp.vectordn_18<br>> 9984 -rw-r--r-- 1 hashumi users 10203905 2010-10-10 04:52<br>> super-sp.vectordn_19<br>> 10024 -rw-r--r-- 1 hashumi users 10245085 2010-10-10 04:52<br>> super-sp.vectordn_20<br>> 10056 -rw-r--r--
1 hashumi users 10276925 2010-10-10 04:52<br>> super-sp.vectordn_21<br>> 10000 -rw-r--r-- 1 hashumi users 10219761 2010-10-10 04:52<br>> super-sp.vectordn_22<br>> 10024 -rw-r--r-- 1 hashumi users 10245085 2010-10-10 04:52<br>> super-sp.vectordn_24<br>> 10036 -rw-r--r-- 1 hashumi users 10257025 2010-10-10 04:52<br>> super-sp.vectordn_23<br>> 0 -rw-r--r-- 1 hashumi users 0 2010-10-10 06:13 super-sp.vectorsoup<br>> Please all give your kind concentration and kindly tell me how can i<br>> solve this matter. i will be very grateful to you.<br>> Thanks and Regards<br>> Arqum Hashmi<br>><br>> *From:* Peter Blaha <<a ymailto="mailto:pblaha@theochem.tuwien.ac.at" href="mailto:pblaha@theochem.tuwien.ac.at">pblaha@theochem.tuwien.ac.at</a>><br>> *To:* A Mailing list for WIEN2k users <<a ymailto="mailto:wien@zeus.theochem.tuwien.ac.at"
href="mailto:wien@zeus.theochem.tuwien.ac.at">wien@zeus.theochem.tuwien.ac.at</a>><br>> *Sent:* Wednesday, February 15, 2012 4:24 AM<br>> *Subject:* Re: [Wien] plz help<br>><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<br>>
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 ymailto="mailto:pblaha@theochem.tuwien.ac.at" href="mailto:pblaha@theochem.tuwien.ac.at">pblaha@theochem.tuwien.ac.at</a><br>> <mailto:<a ymailto="mailto:pblaha@theochem.tuwien.ac.at" href="mailto:pblaha@theochem.tuwien.ac.at">pblaha@theochem.tuwien.ac.at</a>>><br>> > *To:* A Mailing list for WIEN2k users<br>> <<a ymailto="mailto:wien@zeus.theochem.tuwien.ac.at" href="mailto:wien@zeus.theochem.tuwien.ac.at">wien@zeus.theochem.tuwien.ac.at</a> <mailto:<a ymailto="mailto:wien@zeus.theochem.tuwien.ac.at" href="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 ymailto="mailto:Wien@zeus.theochem.tuwien.ac.at" href="mailto:Wien@zeus.theochem.tuwien.ac.at">Wien@zeus.theochem.tuwien.ac.at</a><br>> <mailto:<a ymailto="mailto:Wien@zeus.theochem.tuwien.ac.at" href="mailto:Wien@zeus.theochem.tuwien.ac.at">Wien@zeus.theochem.tuwien.ac.at</a>><br>> <mailto:<a ymailto="mailto:Wien@zeus.theochem.tuwien.ac.at" href="mailto:Wien@zeus.theochem.tuwien.ac.at">Wien@zeus.theochem.tuwien.ac.at</a><br>> <mailto:<a ymailto="mailto:Wien@zeus.theochem.tuwien.ac.at" href="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 ymailto="mailto:Wien@zeus.theochem.tuwien.ac.at" href="mailto:Wien@zeus.theochem.tuwien.ac.at">Wien@zeus.theochem.tuwien.ac.at</a><br>> <mailto:<a ymailto="mailto:Wien@zeus.theochem.tuwien.ac.at" href="mailto:Wien@zeus.theochem.tuwien.ac.at">Wien@zeus.theochem.tuwien.ac.at</a>><br>> <mailto:<a ymailto="mailto:Wien@zeus.theochem.tuwien.ac.at" href="mailto:Wien@zeus.theochem.tuwien.ac.at">Wien@zeus.theochem.tuwien.ac.at</a><br>> <mailto:<a ymailto="mailto:Wien@zeus.theochem.tuwien.ac.at" href="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 ymailto="mailto:Wien@zeus.theochem.tuwien.ac.at" href="mailto:Wien@zeus.theochem.tuwien.ac.at">Wien@zeus.theochem.tuwien.ac.at</a> <mailto:<a ymailto="mailto:Wien@zeus.theochem.tuwien.ac.at" href="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 ymailto="mailto:Wien@zeus.theochem.tuwien.ac.at" href="mailto:Wien@zeus.theochem.tuwien.ac.at">Wien@zeus.theochem.tuwien.ac.at</a> <mailto:<a ymailto="mailto:Wien@zeus.theochem.tuwien.ac.at" href="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 ymailto="mailto:Wien@zeus.theochem.tuwien.ac.at" href="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 ymailto="mailto:Wien@zeus.theochem.tuwien.ac.at" href="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>