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<HTML
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><DIV
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><DIV
CLASS="SECT1"
><H1
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><A
NAME="JOELIB.DESCRIPTOR"
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>Descriptor</H1
><DIV
CLASS="SECT2"
><H2
CLASS="SECT2"
><A
NAME="JOELIB.DESCRIPTORS.ELECTROGEOMETRICALSTATE"
></A
>Electrogeometrical state</H2
><P
>Electrogeometrical state [<A
HREF="bibliography.html#WZ03"
>wz03</A
>,<A
HREF="bibliography.html#WFZ04B"
>wfz04b</A
>].
<DIV
CLASS="EQUATION"
><A
NAME="AEN9"
></A
><P
><B
>Equation 1. Electrogeometrical state</B
></P
><DIV
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><IMG
SRC="formulas/egs.gif"
ALIGN="CENTER"></P
></DIV
></DIV
>
<SPAN
CLASS="bold"
><B
CLASS="EMPHASIS"
>I<SUB
>i</SUB
></B
></SPAN
> is the intrinsic state of atom <SPAN
CLASS="bold"
><B
CLASS="EMPHASIS"
>i</B
></SPAN
> ()
and <SPAN
CLASS="bold"
><B
CLASS="EMPHASIS"
>k</B
></SPAN
> the distance influence.</P
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