[Wien] compile with ifort9 + mkl8 on W2K_06

[hiromasa_kaibe@komatsu.co.jp]

Dear WIEN2K users,

 I am trying to set up a linux machine for W2K_06 as below. So far, it seems to work.
If it helps somebody as one information, I am very happy about it.

Memory: PC4200 JEDEC Buffalo D2U533BK-1GB x 4 (totally 4GB)
Mother board: ASUS P5LD2-VM
            LGA775, chipset 945G, FSB1066, DDR2, VGA integrated, PCI express x 16
CPU: Pentium D
      LGA775, 820 2MB L2 cash, Intel EM64T
Hard Disk: Seagate 250Gbyte ST-3250824AS CFD (serial ATA)
Optical drive: LITEON 16x DVD writer SHM-165P6S10C
LAN: Corega PCI 100M/10M CG-LAPCITX

Installed WIEN2K_06, ifort 9.0 and mkl 8.0.2 on SUSE Linux 10.0.
Compile options are ;

> Current settings:
>      O   Compiler options:        -FR -mp1 -w -prec_div -pc80 -pad -ip -DINTEL_VML
>      L   Linker Flags:            $(FOPT) -L/opt/intel/mkl/8.0.2/lib -lguide
-lpthread
>      P   Preprocessor flags       '-DParallel'
>      R   R_LIB (LAPACK+BLAS):     -L/opt/intel/mkl/8.0.2/lib/em64t -lmkl_lapack
-lmkl_em64t -lguide

And benchmark is

> hiromasa at linux:~/test_case> x lapw1 -c
>  LAPW1 END
> 189.575u 0.768s 3:10.74 99.7%   0+0k 0+0io 1pf+0w

Any comments from everybody are very helpful. I suppose I can optimise more Compiler
option like
-FR -mp1 -w -prec_div -pc80 -pad -ip -DINTEL_VML -O3 -xP.

Hiromasa Kaibe
Thermoelectric Generator Development Dept.,
Komatsu Ltd.
1200, Manda, Hiratsuka-shi,
Kanagawa 254-8567, Japan
phone : +81-463-35-9230
fax : +81-463-35-9287
e-mail : hiromasa_kaibe at komatsu.co.jp