====== ゲルマニウム ======


|[[psp:hydrogen|H]] |                                ||||||||||||||||He|
|Li|Be|                    ||||||||||B |[[:psp:carbon|C]] |N |[[:psp:oxygen|O]] |F |//Ne//|
|Na|Mg|                    ||||||||||Al|Si|P |S |Cl|//Ar//|
|K |Ca|Sc|Ti|V |Cr|Mn|Fe|**[[:psp:cobalt|Co]]**|Ni|Cu|Zn|Ga|[[:psp:germanium|Ge]]|As|//Se//|//Br//|Kr|
|//Rb//|Sr|Y |Zr|Nb|Mo|//Tc//|Ru|Rh|Pd|Ag|Cd|//In//|[[:psp:tin|Sn]]|Sb|Te|//I// |Xe|
|Cs|Ba|La|//Hf//|Ta|W |Re|Os|Ir|Pt|Au|//Hg//|//Tl//|//Pb//|Bi|//Po//|//At//|//Rn//|

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   /usr/share/dacapo/psp/ge_pw91_us_14elec.pseudo
    ============================================================
    |  PSEUDOPOTENTIAL REPORT FOR ATOMIC SPECIES:  2           |
    |        pseudo potential version   7   3   2              |
    ------------------------------------------------------------
    |  germanium(14elec)    Perdew Wang 1991    EXCHANGE-CORR  |
    |  Z(nuclear) =  32.    Z(valence)( 2) =  14.              |
    |  Non linear core correction included: yes                |
    |  Core radius non lin core corr.(RPCOR) =   1.00000   a.u.|
    |  ATOMIC ENERGY = -209.462979690 Ry                       |
    |  Self consistent all electron atomic config:             |
    |  INDEX    ORBITAL      OCCUPATION      ENERGY(Ry)        |
    |    1        320          10.00      -2.160326232         |
    |    2        400           2.00      -0.867607111         |
    |    3        410           2.00      -0.289638983         |
    |  Radii for conservation of augmentation charge moments:  |
    |  RINNER(a.u.) =   1.0000  1.0000  1.0000  1.0000  1.0000                    |
    |  (see Phys Rev B 47 10142 (1993), Eq.28)                 |
    |  NEW GENERATION SCHEME:                                  |
    |  Partial wave set used to generate projectors:           |
    |  Number of radial partial waves (NBETA) =      6         |
    |  Number of radial gridpts per wave (KKBETA) =    621     |
    |  Pseudiz. radius for the local pspot (RCLOC) =  2.00 a.u.|
    |  Partial wave set for generating the pseudopot:          |
    |    IBETA   L        EPSILON(Ry)   RCUT(a.u.)             |
    |      1     0      -2.160326168     2.20                  |
    |      2     0      -0.289624767     2.20                  |
    |      3     1      -0.867584216     1.80                  |
    |      4     1       1.000000000     1.80                  |
    |      5     2      -2.160326168     2.20                  |
    |      6     2      -1.000000000     2.20                  |
    ============================================================
   NCORE:             2    8.138208702541462
   PSP:                       Valence-Z           14.0000
   PSP:                       Core-alpha          92.4090