1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 31 32 33 34 35 36 37 38 39 40 41 42 43 44 45 46 47 48 49 50 51 52 53 54 55 56 57 58 59 60 61 62 63 64 65 66 67 68 69 70 71 72 73 74 75 76 77 78 79 80 81 82 83 84 85 86 87 88 89 90 91 92 93 94 95 96 97 98 99 100 101 102 103 104 105 106 107 108 109 110 111 112 113 114 115 116 117 118 119 120 121 122 123 124 125 126 127 128 129 130 131 132 133 134 135
|
<!DOCTYPE HTML PUBLIC "-//W3C//DTD HTML 3.2 Final//EN">
<!--Converted with LaTeX2HTML 2019.2 (Released June 5, 2019) -->
<HTML lang="EN">
<HEAD>
<TITLE>A..2 Fully relativistic case</TITLE>
<META NAME="description" CONTENT="A..2 Fully relativistic case">
<META NAME="keywords" CONTENT="pseudo-gen">
<META NAME="resource-type" CONTENT="document">
<META NAME="distribution" CONTENT="global">
<META HTTP-EQUIV="Content-Type" CONTENT="text/html; charset=utf-8">
<META NAME="viewport" CONTENT="width=device-width, initial-scale=1.0">
<META NAME="Generator" CONTENT="LaTeX2HTML v2019.2">
<LINK REL="STYLESHEET" HREF="pseudo-gen.css">
<LINK REL="next" HREF="node18.html">
<LINK REL="previous" HREF="node16.html">
<LINK REL="next" HREF="node18.html">
</HEAD>
<BODY >
<!--Navigation Panel-->
<A
HREF="node18.html">
<IMG WIDTH="37" HEIGHT="24" ALT="next" SRC="next.png"></A>
<A
HREF="node15.html">
<IMG WIDTH="26" HEIGHT="24" ALT="up" SRC="up.png"></A>
<A
HREF="node16.html">
<IMG WIDTH="63" HEIGHT="24" ALT="previous" SRC="prev.png"></A>
<A ID="tex2html132"
HREF="node1.html">
<IMG WIDTH="65" HEIGHT="24" ALT="contents" SRC="contents.png"></A>
<BR>
<B> Next:</B> <A
HREF="node18.html">A..3 Scalar-relativistic case</A>
<B> Up:</B> <A
HREF="node15.html">A. Atomic Calculations</A>
<B> Previous:</B> <A
HREF="node16.html">A..1 Nonrelativistic case</A>
<B> <A ID="tex2html133"
HREF="node1.html">Contents</A></B>
<BR>
<BR>
<!--End of Navigation Panel-->
<H2><A ID="SECTION00052000000000000000">
A..2 Fully relativistic case</A>
</H2>
<P>
<EM>The relativistic KS equations are
Dirac-like equations for a spinor with a ``large'' <!-- MATH
$R_{nlj}(r)$
-->
<I>R</I><SUB>nlj</SUB>(<I>r</I>) and
a ``small'' <!-- MATH
$S_{nlj}(r)$
-->
<I>S</I><SUB>nlj</SUB>(<I>r</I>) component:
</EM>
<BR>
<DIV ALIGN="CENTER">
<!-- MATH
\begin{eqnarray}
c\left({d \over dr} + {\kappa\over r}\right)R_{nlj}(r) & = &
\left(2mc^2 - V(r) + \epsilon \right)S_{nlj}(r)\\
c\left({d \over dr} - {\kappa\over r}\right)S_{nlj}(r) & = &
\left( V(r) + \epsilon \right) R_{nlj}(r)
\end{eqnarray}
-->
<TABLE CELLPADDING="0" ALIGN="CENTER" WIDTH="100%">
<TR VALIGN="MIDDLE"><TD NOWRAP ALIGN="RIGHT"><I>c</I><IMG STYLE="height: 5.60ex; vertical-align: -2.30ex; " SRC="img50.png"
ALT="$\displaystyle \left(\vphantom{{d \over dr} + {\kappa\over r}}\right.$"><IMG STYLE="height: 4.84ex; vertical-align: -1.69ex; " SRC="img51.png"
ALT="$\displaystyle {d \over dr}$"> + <IMG STYLE="height: 4.25ex; vertical-align: -1.69ex; " SRC="img52.png"
ALT="$\displaystyle {\kappa\over r}$"><IMG STYLE="height: 5.60ex; vertical-align: -2.30ex; " SRC="img53.png"
ALT="$\displaystyle \left.\vphantom{{d \over dr} + {\kappa\over r}}\right)$"><I>R</I><SUB>nlj</SUB>(<I>r</I>)</TD>
<TD WIDTH="10" ALIGN="CENTER" NOWRAP>=</TD>
<TD ALIGN="LEFT" NOWRAP><IMG STYLE="height: 2.80ex; vertical-align: -0.91ex; " SRC="img54.png"
ALT="$\displaystyle \left(\vphantom{2mc^2 - V(r) + \epsilon }\right.$">2<I>mc</I><SUP>2</SUP> - <I>V</I>(<I>r</I>) + <I>ε</I><IMG STYLE="height: 2.80ex; vertical-align: -0.91ex; " SRC="img55.png"
ALT="$\displaystyle \left.\vphantom{2mc^2 - V(r) + \epsilon }\right)$"><I>S</I><SUB>nlj</SUB>(<I>r</I>)</TD>
<TD WIDTH=10 ALIGN="RIGHT">
(9)</TD></TR>
<TR VALIGN="MIDDLE"><TD NOWRAP ALIGN="RIGHT"><I>c</I><IMG STYLE="height: 5.60ex; vertical-align: -2.30ex; " SRC="img56.png"
ALT="$\displaystyle \left(\vphantom{{d \over dr} - {\kappa\over r}}\right.$"><IMG STYLE="height: 4.84ex; vertical-align: -1.69ex; " SRC="img51.png"
ALT="$\displaystyle {d \over dr}$"> - <IMG STYLE="height: 4.25ex; vertical-align: -1.69ex; " SRC="img52.png"
ALT="$\displaystyle {\kappa\over r}$"><IMG STYLE="height: 5.60ex; vertical-align: -2.30ex; " SRC="img57.png"
ALT="$\displaystyle \left.\vphantom{{d \over dr} - {\kappa\over r}}\right)$"><I>S</I><SUB>nlj</SUB>(<I>r</I>)</TD>
<TD WIDTH="10" ALIGN="CENTER" NOWRAP>=</TD>
<TD ALIGN="LEFT" NOWRAP><IMG STYLE="height: 2.33ex; vertical-align: -0.68ex; " SRC="img58.png"
ALT="$\displaystyle \left(\vphantom{ V(r) + \epsilon }\right.$"><I>V</I>(<I>r</I>) + <I>ε</I><IMG STYLE="height: 2.33ex; vertical-align: -0.68ex; " SRC="img59.png"
ALT="$\displaystyle \left.\vphantom{ V(r) + \epsilon }\right)$"><I>R</I><SUB>nlj</SUB>(<I>r</I>)</TD>
<TD WIDTH=10 ALIGN="RIGHT">
(10)</TD></TR>
</TABLE></DIV>
<BR CLEAR="ALL">
<EM>
where <I>j</I> is the total angular momentum (<I>j</I> = 1/2 if <I>l</I> = 0,
<!-- MATH
$j=l+1/2,l-1/2$
-->
<I>j</I> = <I>l</I> + 1/2, <I>l</I> - 1/2 otherwise); <!-- MATH
$\kappa=-2(j-l)(j+1/2)$
-->
<I>κ</I> = - 2(<I>j</I> - <I>l</I> )(<I>j</I> + 1/2) is the Dirac
quantum number (<I>κ</I> = - 1 is <I>l</I> = 0, <!-- MATH
$\kappa=-l-1,l$
-->
<I>κ</I> = - <I>l</I> - 1, <I>l</I> otherwise);
and the charge density is given by
</EM>
<P></P>
<DIV ALIGN="CENTER">
<!-- MATH
\begin{equation}
n(r) = \sum_{nlj} \Theta_{nlj}{R^2_{nlj}(r)+S^2_{nlj}(r)\over 4\pi r^2}.
\end{equation}
-->
<TABLE WIDTH="100%" ALIGN="CENTER">
<TR VALIGN="MIDDLE"><TD ALIGN="CENTER" NOWRAP>
<I>n</I>(<I>r</I>) = <IMG STYLE="height: 5.30ex; vertical-align: -3.37ex; " SRC="img60.png"
ALT="$\displaystyle \sum_{{nlj}}^{}$"><I>Θ</I><SUB>nlj</SUB><IMG STYLE="height: 5.36ex; vertical-align: -1.69ex; " SRC="img61.png"
ALT="$\displaystyle {R^2_{nlj}(r)+S^2_{nlj}(r)\over 4\pi r^2}$">.
</TD>
<TD WIDTH=10 ALIGN="RIGHT">
(11)</TD></TR>
</TABLE>
</DIV>
<P>
<BR><HR>
</BODY>
</HTML>
|