Dear WIEN2k members, I am trying to compile the latest version of the code using FC10 (Intel ifort 11.1 compiler + mkl) on an isolated 64 bit intel 4 cores system and an isolated 32 bit intel 2 cores system. For the 32 bit system I do not have any problem even under FC11, FC12, and FC13, and the code works fine. But for the former 64 bit system there is the following error in compile.msg files:
"/opt/intel/Compiler/11.1/072/bin/intel64/fortcom: error while loading shared libraries: libstdc++.so.5: cannot open shared object file: No such file or directory" This is in the case that I have already installed the libstdc++.so.5 library, as it is also necessary for installing the intel ifort 11.1 compiler. Although in FC10 the libstdc++.so.6 is installed, the libstdc++.so.5 is also needed for installing intel ifort 11.1 compiler. Therefore, I installed the later library and all of its components using yum as "yum install libstdc++.so.5". After this the l_cprof_p_11.1.072 is completely and successfully installed. I added the following two lines in .bashrc: source /opt/intel/Compiler/11.1/072/mkl/tools/environment/mklvars64.sh source /opt/intel/Compiler/11.1/072/bin/intel64/ifortvars_intel64.sh Then siteconfig_lapw recognized ifort and mkl. The libstdc++.so.5 is installed in /usr/lib in the 32 bit system, where the libstdc++.so.6 was installed. The libstdc++.so.5 is installed in /usr/lib in the 64 bit system, while the libstdc++.so.6 was installed in another directory of /usr/lib64. In the directory of /usr/lib on the 32 bit system there are: #find -name "libsdtc*" ./gcc/x86_64-redhat-linux/4.4.4/libstdc++.so ./gcc/x86_64-redhat-linux/4.4.4/32/libstdc++.so ./gcc/x86_64-redhat-linux/4.4.4/32/libstdc++.a ./gcc/x86_64-redhat-linux/4.4.4/libstdc++.a ./libstdc++.so.5.0.7 ./libstdc++.so.5 In the directory of /usr/lib on the 64 bit system there are: #find -name "libsdtc*" ./gcc/x86_64-redhat-linux/4.3.2/libstdc++.a ./gcc/x86_64-redhat-linux/4.3.2/32/libstdc++.a ./gcc/x86_64-redhat-linux/4.3.2/32/libstdc++.so ./gcc/x86_64-redhat-linux/4.3.2/libstdc++.so ./libstdc++.so.5.0.7 ./libstdc++.so.5 In the directory of /usr/lib64 on the 64 bit system there are: #find -name "libsdtc*" ./libstdc++.so.6.0.10 ./libstdc++.so.6 For the 64 bit system, I added the /usr/lib path to the $PATH, but still the problem exists. Any reply is highly appreciated. Sincerely yours, S. Jalali /_/_/_/_/_/_/_/_/_/_/_/_/_/_/_/_/_/_/_/_/_/_/_/_/_/ Saeid Jalali Asadabadi, Department of Physics, Faculty of Science, University of Isfahan (UI), Hezar Gerib Avenue, 81744 Isfahan, Iran. Phones: Dep. of Phys. :+98-0311-793 2435 Office :+98-0311-793 4176 Fax No. :+98-0311-793 2409 E-mail :sjalali at phys.ui.ac.ir Homepage :http://sci.ui.ac.ir/~sjalali www :http://www.ui.ac.ir /_/_/_/_/_/_/_/_/_/_/_/_/_/_/_/_/_/_/_/_/_/_/_/_/_/ >-----Original Message----- >From: wien-bounces at zeus.theochem.tuwien.ac.at [mailto:wien- >bounces at zeus.theochem.tuwien.ac.at] On Behalf Of Laurence Marks >Sent: Sunday, September 26, 2010 5:41 PM >To: A Mailing list for WIEN2k users >Subject: *** SPAM *** [5.7] Re: [Wien] Slab convergence -- continuation > >An additional comment/question -- did you use the default spin setting >in instgen_lapw? I wonder if you did, and that in the converged >density the Au is mainly non-polarized except slightly at the surface. >However, you started it with all the Au polarized and it will take >many iterations for the spin to come down to close to the correct >value, and only then will it converge. > >If I am right, you can look at this in case.scfm (or case.scf) and, >next time, edit your case.inst by hand or use the option that allows >you to specify for each atom. Starting closer to the right spin >coupled with using a centro-symmetric cell will probably solve your >problems. > >On Sat, Sep 25, 2010 at 5:33 PM, Laurence Marks ><L-marks at northwestern.edu> wrote: >> There is nothing wrong, it is converging slowly and my guess is that >> it will need 60-80 iterations as you currently have it modelled. If >> you have only run it for 20 iterations, do another 20 and use the -NI >> option so it keeps going. DO NOT RESTART from dstart. >> >> N.B., the forces are not meaningful unless you have "FOR" instead of >> "TOT" and the densities are much better converged than this. >> >> On Sat, Sep 25, 2010 at 5:14 PM, Lukasz Plucinski >> <pluto at physics.ucdavis.edu> wrote: >>> ?Dear Laurence, Prof. Blaha, >>> >>> 19 iterations with settings suggested by Prof. Blaha have passed >(still with >>> complex version of the program), but I guess there are no signs of >>> convergence. I will keep working on this, and I am sure it will work >at the >>> end, especially that I made big progress already :) Next step would >be to >>> run smaller slab, like Fe1Au10, and try the non-complex version. >>> >>> In any case I decided to paste the output of the grep file you have >proposed >>> - maybe you will immediately see some obvious problem (Fe is atom 21 >and it >>> connects to Au atom 1). At the end I also print the forces for the >last >>> iteration and forces for Fe atom over the 19 iterations - maybe those >are >>> too high... >>> >>> lplucin at iff187:Fe1Au20% grep -e :DIR -e GREED -e :FRMS -e :ENE -e >:CHARG -e >>> PRATT -e :DIS -e "MIXING SC" -e PLANE *.scf $1 >>> :DIS ?: ?CHARGE DISTANCE ? ? ? ( 1.8369011 for atom ? 21 spin 2) >>> ?0.7633234 >>> :PLANE: ?INTERSTITIAL TOTAL ? ?118.34106 DISTAN ?0.118D+01 % >>> :CHARG: ?CLM CHARGE ? TOTAL ? ? 83.39867 DISTAN ?0.136D+01 % >>> ? ? ? PRATT MIXING SCHEME WITH 0.025 >>> :ENE ?: ********** TOTAL ENERGY IN Ry = ? ? ?-764461.70817746 >>> :DIS ?: ?CHARGE DISTANCE ? ? ? ( 3.4564629 for atom ? ?1 spin 2) >>> ?1.8459239 >>> :PLANE: ?INTERSTITIAL TOTAL ? ?115.72078 DISTAN ?0.110D+01 % >>> :CHARG: ?CLM CHARGE ? TOTAL ? ? 83.39736 DISTAN ?0.376D+01 % >>> :DIRM : ?MEMORY 1/8 RESCALE ?2.905 RED ?2.494 PRED ?1.000 NEXT ?0.367 >>> :DIRP : ?|BROYD|= 0.747D-01 |PRATT|= 0.155D+00 ANGLE= 163.0 DEGREES >>> :DIRB : ?|BROYD|= 0.254D+00 |PRATT|= 0.921D+00 ANGLE= ?55.5 DEGREES >>> ? ? ? MSEC1 MIXING SCHEME WITH 0.015 >>> :ENE ?: *WARNING** TOTAL ENERGY IN Ry = ? ? ?-764479.28101496 >>> :DIS ?: ?CHARGE DISTANCE ? ? ? ( 1.9111839 for atom ? 21 spin 2) >>> ?0.9887058 >>> :PLANE: ?INTERSTITIAL TOTAL ? ?116.39701 DISTAN ?0.116D+01 % >>> :CHARG: ?CLM CHARGE ? TOTAL ? ? 83.39749 DISTAN ?0.173D+01 % >>> :DIRM : ?MEMORY 2/8 RESCALE ?2.838 RED ?0.487 PRED ?0.367 NEXT ?0.748 >>> :DIRP : ?|BROYD|= 0.183D+00 |PRATT|= 0.321D+00 ANGLE= ? 3.9 DEGREES >>> :DIRB : ?|BROYD|= 0.378D+00 |PRATT|= 0.896D+00 ANGLE= ?38.8 DEGREES >>> ? ? ? MSEC1 MIXING SCHEME WITH 0.030 >>> :ENE ?: ********** TOTAL ENERGY IN Ry = ? ? ?-764463.27396102 >>> :DIS ?: ?CHARGE DISTANCE ? ? ? ( 2.0879620 for atom ? 21 spin 2) >>> ?1.1862428 >>> :PLANE: ?INTERSTITIAL TOTAL ? ?114.65422 DISTAN ?0.115D+01 % >>> :CHARG: ?CLM CHARGE ? TOTAL ? ? 83.39637 DISTAN ?0.200D+01 % >>> :DIRM : ?MEMORY 3/8 RESCALE ?2.865 RED ?1.133 PRED ?0.748 NEXT ?0.661 >>> :DIRP : ?|BROYD|= 0.313D-01 |PRATT|= 0.280D+00 ANGLE= 172.8 DEGREES >>> :DIRB : ?|BROYD|= 0.639D-01 |PRATT|= 0.897D+00 ANGLE= 124.3 DEGREES >>> ? ? ? MSEC1 MIXING SCHEME WITH 0.026 >>> :ENE ?: ********** TOTAL ENERGY IN Ry = ? ? ?-764465.27438637 >>> :DIS ?: ?CHARGE DISTANCE ? ? ? ( 1.9582611 for atom ? 21 spin 2) >>> ?1.0047914 >>> :PLANE: ?INTERSTITIAL TOTAL ? ?114.94778 DISTAN ?0.116D+01 % >>> :CHARG: ?CLM CHARGE ? TOTAL ? ? 83.39654 DISTAN ?0.172D+01 % >>> :DIRM : ?MEMORY 4/8 RESCALE ?2.835 RED ?0.874 PRED ?0.661 NEXT ?0.648 >>> :DIRP : ?|BROYD|= 0.637D+00 |PRATT|= 0.320D+00 ANGLE= ? 4.9 DEGREES >>> :DIRB : ?|BROYD|= 0.121D+01 |PRATT|= 0.896D+00 ANGLE= ?39.2 DEGREES >>> ? ? ? MSEC1 MIXING SCHEME WITH 0.030 >>> :ENE ?: ********** TOTAL ENERGY IN Ry = ? ? ?-764463.63839698 >>> :DIS ?: ?CHARGE DISTANCE ? ? ? ( 2.3237103 for atom ? 21 spin 2) >>> ?1.7790288 >>> :PLANE: ?INTERSTITIAL TOTAL ? ?108.90635 DISTAN ?0.114D+01 % >>> :CHARG: ?CLM CHARGE ? TOTAL ? ? 83.39379 DISTAN ?0.297D+01 % >>> :DIRM : ?MEMORY 5/8 RESCALE ?2.939 RED ?1.644 PRED ?0.648 NEXT ?0.385 >>> :DIRP : ?|BROYD|= 0.488D-02 |PRATT|= 0.188D+00 ANGLE= ?86.6 DEGREES >>> :DIRB : ?|BROYD|= 0.870D-01 |PRATT|= 0.900D+00 ANGLE= ?53.0 DEGREES >>> ? ? ? MSEC1 MIXING SCHEME WITH 0.018 >>> :ENE ?: *WARNING** TOTAL ENERGY IN Ry = ? ? ?-764472.65423111 >>> :DIS ?: ?CHARGE DISTANCE ? ? ? ( 0.6292669 for atom ? ?2 spin 2) >>> ?0.7338108 >>> :PLANE: ?INTERSTITIAL TOTAL ? ?108.91944 DISTAN ?0.115D+01 % >>> :CHARG: ?CLM CHARGE ? TOTAL ? ? 83.39367 DISTAN ?0.962D+00 % >>> :DIRM : ?MEMORY 6/8 RESCALE ?2.760 RED ?0.375 PRED ?0.385 NEXT ?0.785 >>> :DIRP : ?|BROYD|= 0.304D+00 |PRATT|= 0.356D+00 ANGLE= ? 3.3 DEGREES >>> :DIRB : ?|BROYD|= 0.453D+00 |PRATT|= 0.673D+00 ANGLE= ?35.6 DEGREES >>> ? ? ? MSEC1 MIXING SCHEME WITH 0.037 >>> :ENE ?: ********** TOTAL ENERGY IN Ry = ? ? ?-764462.68273654 >>> :DIS ?: ?CHARGE DISTANCE ? ? ? ( 1.4736987 for atom ? 21 spin 2) >>> ?0.7422774 >>> :PLANE: ?INTERSTITIAL TOTAL ? ?106.01865 DISTAN ?0.113D+01 % >>> :CHARG: ?CLM CHARGE ? TOTAL ? ? 83.39239 DISTAN ?0.215D+01 % >>> :DIRM : ?MEMORY 7/8 RESCALE ?2.806 RED ?1.952 PRED ?0.785 NEXT ?0.410 >>> :DIRP : ?|BROYD|= 0.290D+00 |PRATT|= 0.178D+00 ANGLE= 175.8 DEGREES >>> :DIRB : ?|BROYD|= 0.438D+00 |PRATT|= 0.676D+00 ANGLE= 110.2 DEGREES >>> ? ? ? MSEC1 MIXING SCHEME WITH 0.019 >>> :ENE ?: ********** TOTAL ENERGY IN Ry = ? ? ?-764463.06753755 >>> :DIS ?: ?CHARGE DISTANCE ? ? ? ( 1.3977454 for atom ? 21 spin 2) >>> ?0.6630361 >>> :PLANE: ?INTERSTITIAL TOTAL ? ?108.75537 DISTAN ?0.115D+01 % >>> :CHARG: ?CLM CHARGE ? TOTAL ? ? 83.39365 DISTAN ?0.158D+01 % >>> :DIRM : ?MEMORY 8/8 RESCALE ?2.793 RED ?0.761 PRED ?0.410 NEXT ?0.520 >>> :DIRP : ?|BROYD|= 0.579D+00 |PRATT|= 0.243D+00 ANGLE= ? 2.6 DEGREES >>> :DIRB : ?|BROYD|= 0.102D+01 |PRATT|= 0.676D+00 ANGLE= ?73.8 DEGREES >>> ? ? ? MSEC1 MIXING SCHEME WITH 0.025 >>> :ENE ?: ********** TOTAL ENERGY IN Ry = ? ? ?-764461.86144927 >>> :DIS ?: ?CHARGE DISTANCE ? ? ? ( 1.5359856 for atom ? 21 spin 2) >>> ?0.6783981 >>> :PLANE: ?INTERSTITIAL TOTAL ? ?103.24631 DISTAN ?0.114D+01 % >>> :CHARG: ?CLM CHARGE ? TOTAL ? ? 83.39129 DISTAN ?0.217D+01 % >>> :DIRM : ?MEMORY 8/8 RESCALE ?2.901 RED ?1.321 PRED ?0.520 NEXT ?0.404 >>> :DIRP : ?|BROYD|= 0.111D+00 |PRATT|= 0.179D+00 ANGLE= ? 5.0 DEGREES >>> :DIRB : ?|BROYD|= 0.438D+00 |PRATT|= 0.679D+00 ANGLE= ?94.5 DEGREES >>> ? ? ? MSEC1 MIXING SCHEME WITH 0.019 >>> :ENE ?: ********** TOTAL ENERGY IN Ry = ? ? ?-764462.76680261 >>> :DIS ?: ?CHARGE DISTANCE ? ? ? ( 1.5635417 for atom ? 21 spin 2) >>> ?0.6769593 >>> :PLANE: ?INTERSTITIAL TOTAL ? ?102.21850 DISTAN ?0.113D+01 % >>> :CHARG: ?CLM CHARGE ? TOTAL ? ? 83.39069 DISTAN ?0.218D+01 % >>> :DIRM : ?MEMORY 8/8 RESCALE ?2.856 RED ?1.003 PRED ?0.404 NEXT ?0.393 >>> :DIRP : ?|BROYD|= 0.741D-01 |PRATT|= 0.173D+00 ANGLE= ?10.2 DEGREES >>> :DIRB : ?|BROYD|= 0.550D+00 |PRATT|= 0.678D+00 ANGLE= ?67.7 DEGREES >>> ? ? ? MSEC1 MIXING SCHEME WITH 0.019 >>> :ENE ?: ********** TOTAL ENERGY IN Ry = ? ? ?-764462.80353390 >>> :DIS ?: ?CHARGE DISTANCE ? ? ? ( 1.3885591 for atom ? 21 spin 2) >>> ?0.6168273 >>> :PLANE: ?INTERSTITIAL TOTAL ? ?101.58134 DISTAN ?0.114D+01 % >>> :CHARG: ?CLM CHARGE ? TOTAL ? ? 83.39058 DISTAN ?0.127D+01 % >>> :DIRM : ?MEMORY 8/8 RESCALE ?2.826 RED ?0.617 PRED ?0.393 NEXT ?0.453 >>> :DIRP : ?|BROYD|= 0.333D+01 |PRATT|= 0.278D+00 ANGLE= ? 3.0 DEGREES >>> :DIRB : ?|BROYD|= 0.506D+01 |PRATT|= 0.678D+00 ANGLE= ?66.0 DEGREES >>> ? ? ? MSEC1 MIXING SCHEME WITH 0.030 >>> :ENE ?: ********** TOTAL ENERGY IN Ry = ? ? ?-764461.99355790 >>> :DIS ?: ?CHARGE DISTANCE ? ? ? ( 1.1568872 for atom ? 14 spin 2) >>> ?0.6685332 >>> :PLANE: ?INTERSTITIAL TOTAL ? ? 73.66428 DISTAN ?0.100D+01 % >>> :CHARG: ?CLM CHARGE ? TOTAL ? ? 83.37899 DISTAN ?0.113D+01 % >>> :DIRM : ?MEMORY 8/8 RESCALE ?2.827 RED ?0.851 PRED ?0.453 NEXT ?0.536 >>> :DIRP : ?|BROYD|= 0.568D-01 |PRATT|= 0.208D+00 ANGLE= ? 8.8 DEGREES >>> :DIRB : ?|BROYD|= 0.242D+00 |PRATT|= 0.678D+00 ANGLE= ?65.5 DEGREES >>> ? ? ? MSEC1 MIXING SCHEME WITH 0.036 >>> :ENE ?: ********** TOTAL ENERGY IN Ry = ? ? ?-764462.86242784 >>> :DIS ?: ?CHARGE DISTANCE ? ? ? ( 1.4264538 for atom ? 21 spin 2) >>> ?0.4879323 >>> :PLANE: ?INTERSTITIAL TOTAL ? ? 73.25877 DISTAN ?0.999D+00 % >>> :CHARG: ?CLM CHARGE ? TOTAL ? ? 83.37952 DISTAN ?0.123D+01 % >>> :DIRM : ?MEMORY 8/8 RESCALE ?2.868 RED ?1.083 PRED ?0.536 NEXT ?0.385 >>> :DIRP : ?|BROYD|= 0.227D+01 |PRATT|= 0.193D+00 ANGLE= ? 5.2 DEGREES >>> :DIRB : ?|BROYD|= 0.315D+01 |PRATT|= 0.679D+00 ANGLE= ?69.6 DEGREES >>> ? ? ? MSEC1 MIXING SCHEME WITH 0.033 >>> :ENE ?: ********** TOTAL ENERGY IN Ry = ? ? ?-764461.97659644 >>> :DIS ?: ?CHARGE DISTANCE ? ? ? ( 1.6982287 for atom ? 21 spin 2) >>> ?0.5405554 >>> :PLANE: ?INTERSTITIAL TOTAL ? ? 59.47974 DISTAN ?0.742D+00 % >>> :CHARG: ?CLM CHARGE ? TOTAL ? ? 83.37338 DISTAN ?0.204D+01 % >>> :DIRM : ?MEMORY 8/8 RESCALE ?2.915 RED ?1.595 PRED ?0.385 NEXT ?0.206 >>> :DIRP : ?|BROYD|= 0.140D+01 |PRATT|= 0.743D-01 ANGLE= ? 7.8 DEGREES >>> :DIRB : ?|BROYD|= 0.190D+01 |PRATT|= 0.680D+00 ANGLE= ?71.7 DEGREES >>> ? ? ? MSEC1 MIXING SCHEME WITH 0.021 >>> :ENE ?: ********** TOTAL ENERGY IN Ry = ? ? ?-764462.61304845 >>> :DIS ?: ?CHARGE DISTANCE ? ? ? ( 1.4697547 for atom ? 21 spin 2) >>> ?0.4979709 >>> :PLANE: ?INTERSTITIAL TOTAL ? ? 53.21152 DISTAN ?0.524D+00 % >>> :CHARG: ?CLM CHARGE ? TOTAL ? ? 83.37088 DISTAN ?0.129D+01 % >>> :DIRM : ?MEMORY 8/8 RESCALE ?3.211 RED ?0.632 PRED ?0.206 NEXT ?0.429 >>> :DIRP : ?|BROYD|= 0.132D+00 |PRATT|= 0.819D-01 ANGLE= 161.5 DEGREES >>> :DIRB : ?|BROYD|= 0.491D+00 |PRATT|= 0.681D+00 ANGLE= ?64.0 DEGREES >>> ? ? ? MSEC1 MIXING SCHEME WITH 0.033 >>> :ENE ?: ********** TOTAL ENERGY IN Ry = ? ? ?-764462.19383195 >>> :DIS ?: ?CHARGE DISTANCE ? ? ? ( 2.2846737 for atom ? ?2 spin 2) >>> ?0.9802665 >>> :PLANE: ?INTERSTITIAL TOTAL ? ? 53.64758 DISTAN ?0.517D+00 % >>> :CHARG: ?CLM CHARGE ? TOTAL ? ? 83.37173 DISTAN ?0.245D+01 % >>> :DIRM : ?MEMORY 8/8 RESCALE ?3.366 RED ?1.894 PRED ?0.429 NEXT ?0.216 >>> :DIRP : ?|BROYD|= 0.320D-01 |PRATT|= 0.450D-01 ANGLE= 142.6 DEGREES >>> :DIRB : ?|BROYD|= 0.240D+00 |PRATT|= 0.681D+00 ANGLE= ?92.6 DEGREES >>> ? ? ? MSEC1 MIXING SCHEME WITH 0.017 >>> :ENE ?: ********** TOTAL ENERGY IN Ry = ? ? ?-764465.78776379 >>> :DIS ?: ?CHARGE DISTANCE ? ? ? ( 2.0226278 for atom ? ?2 spin 2) >>> ?0.7593622 >>> :PLANE: ?INTERSTITIAL TOTAL ? ? 53.76097 DISTAN ?0.530D+00 % >>> :CHARG: ?CLM CHARGE ? TOTAL ? ? 83.37277 DISTAN ?0.180D+01 % >>> :DIRM : ?MEMORY 8/8 RESCALE ?3.627 RED ?0.735 PRED ?0.216 NEXT ?0.318 >>> :DIRP : ?|BROYD|= 0.174D+00 |PRATT|= 0.679D-01 ANGLE= ?18.9 DEGREES >>> :DIRB : ?|BROYD|= 0.600D+00 |PRATT|= 0.681D+00 ANGLE= ?89.4 DEGREES >>> ? ? ? MSEC1 MIXING SCHEME WITH 0.023 >>> :ENE ?: ********** TOTAL ENERGY IN Ry = ? ? ?-764463.66314145 >>> :DIS ?: ?CHARGE DISTANCE ? ? ? ( 1.7094630 for atom ? 21 spin 2) >>> ?0.7114884 >>> :PLANE: ?INTERSTITIAL TOTAL ? ? 53.15388 DISTAN ?0.497D+00 % >>> :CHARG: ?CLM CHARGE ? TOTAL ? ? 83.37101 DISTAN ?0.220D+01 % >>> :DIRM : ?MEMORY 8/8 RESCALE ?3.839 RED ?1.225 PRED ?0.318 NEXT ?0.208 >>> :DIRP : ?|BROYD|= 0.111D+01 |PRATT|= 0.544D-01 ANGLE= ?19.6 DEGREES >>> :DIRB : ?|BROYD|= 0.140D+01 |PRATT|= 0.682D+00 ANGLE= ?72.8 DEGREES >>> ? ? ? MSEC1 MIXING SCHEME WITH 0.019 >>> :ENE ?: ********** TOTAL ENERGY IN Ry = ? ? ?-764464.34795513 >>> >> >> >> -- >> Laurence Marks >> Department of Materials Science and Engineering >> MSE Rm 2036 Cook Hall >> 2220 N Campus Drive >> Northwestern University >> Evanston, IL 60208, USA >> Tel: (847) 491-3996 Fax: (847) 491-7820 >> email: L-marks at northwestern dot edu >> Web: www.numis.northwestern.edu >> Chair, Commission on Electron Crystallography of IUCR >> www.numis.northwestern.edu/ >> Electron crystallography is the branch of science that uses electron >> scattering and imaging to study the structure of matter. >> > > > >-- >Laurence Marks >Department of Materials Science and Engineering >MSE Rm 2036 Cook Hall >2220 N Campus Drive >Northwestern University >Evanston, IL 60208, USA >Tel: (847) 491-3996 Fax: (847) 491-7820 >email: L-marks at northwestern dot edu >Web: www.numis.northwestern.edu >Chair, Commission on Electron Crystallography of IUCR >www.numis.northwestern.edu/ >Electron crystallography is the branch of science that uses electron >scattering and imaging to study the structure of matter. >_______________________________________________ >Wien mailing list >Wien at zeus.theochem.tuwien.ac.at >http://zeus.theochem.tuwien.ac.at/mailman/listinfo/wien
