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processor       : 0
vendor_id       : AuthenticAMD
cpu family      : 16
model           : 5
model name      : AMD Athlon(tm) II X4 620 Processor
stepping        : 2
cpu MHz         : 800.000
cache size      : 512 KB
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feverforce

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Originally posted by springxa at 2010-03-18 00:04:46:
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---------------------------------------------------------------------
Center     Atomic     Atomic              Coordinates (Angstroms)
Number     Number      Type              X           Y           Z
---------------------------------------------------------------------
    1          8             0        0.000000    0.000000    0.000000
    2          1             0        0.000000    0.000000    0.960000
    3          1             0        0.905097    0.000000   -0.320000
---------------------------------------------------------------------
                    Distance matrix (angstroms):
                    1          2          3
     1  O    0.000000
     2  H    0.960000   0.000000
     3  H    0.960000   1.567673   0.000000
Stoichiometry    H2O
Framework group  C2V[C2(O),SGV(H2)]
Deg. of freedom     2
Full point group                 C2V
Largest Abelian subgroup         C2V     NOp   4
Largest concise Abelian subgroup C2      NOp   2
                         Standard orientation:                        
---------------------------------------------------------------------
Center     Atomic     Atomic              Coordinates (Angstroms)
Number     Number      Type              X           Y           Z
---------------------------------------------------------------------
    1          8             0        0.000000    0.000000    0.110851
    2          1             0        0.000000    0.783837   -0.443405
    3          1             0        0.000000   -0.783837   -0.443405
---------------------------------------------------------------------
Rotational constants (GHZ):    919.0227235    408.0852058    282.5991534
Standard basis: STO-3G (5D, 7F)
There are     4 symmetry adapted basis functions of A1  symmetry.
There are     0 symmetry adapted basis functions of A2  symmetry.
There are     1 symmetry adapted basis functions of B1  symmetry.
There are     2 symmetry adapted basis functions of B2  symmetry.
Integral buffers will be    131072 words long.
Raffenetti 1 integral format.
Two-electron integral symmetry is turned on.
     7 basis functions,    21 primitive gaussians,     7 cartesian basis functions
     5 alpha electrons        5 beta electrons
       nuclear repulsion energy         9.1571759050 Hartrees.
NAtoms=    3 NActive=    3 NUniq=    2 SFac= 1.69D+00 NAtFMM=   80 NAOKFM=F Big=F
One-electron integrals computed using PRISM.
3Â¥2010-03-18 00:14:23
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springxa

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2Â¥2010-03-18 00:04:46
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feverforce

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yjcmwgk(½ð±Ò+2):¹ÄÀø×Ô¼ºÑо¿ÎÊÌ⣬ºÇºÇ 2010-03-18 20:33
×Ô¼ºÕÒµ½½â¾ö°ì·¨ÁË-_-||ÓÃFedoraµÄ¸÷λͬѧ¿ÉÒԲο¼²Î¿¼

Old  11-17-2006, 07:55 AM              #13
fedorie
LQ Newbie

Registered: Nov 2006
Posts: 1
Thanked: 0
       
Hi,
Don't know if you guys are still having these problems, but the official answer of Gaussian is, that they do not support FC, although their suggested solution:

echo 0 > /proc/sys/kernel/randomize_va_space

works (normally it reads 1).
If you don't want to this everytime you reboot, you can add this line to
/etc/rc.local
G03 works fine with that solution on both FC4 & FC5 (don't know about FC6 yet though)
Hope this helps,
Fedor

http://www.linuxquestions.org/qu ... dora-core-5-455395/
4Â¥2010-03-18 17:03:50
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