LDA and GGA Investigations of Some Ground-State Properties and the Compton Profile of Copper with the All-Electron MAPW Method

<table>Difference between experimental [<a href="/journals/isrn/2012/975897/#B51">52</a>] and theoretical all-electron profiles along the <svg height="13.125" id="M331" style="vertical-align:-1.95624pt" version="1.1" viewbox="0 0 33.974998 13.125" width="33.974998" xmlns="http://www.w3.org/2000/svg">
<g transform="matrix(1.25,0,0,-1.25,0,13.125)">
<g transform="translate(72,-61.5)">
<text transform="matrix(1,0,0,-1,-71.95,63.5)">
<tspan style="font-size: 12.50px; " x="0" y="0">[</tspan>
<tspan style="font-size: 12.50px; " x="4.1634989" y="0">1</tspan>
<tspan style="font-size: 12.50px; " x="10.414999" y="0">1</tspan>
<tspan style="font-size: 12.50px; " x="16.666498" y="0">0</tspan>
<tspan style="font-size: 12.50px; " x="22.917999" y="0">]</tspan>
</text>
</g>
</g>
</svg> directions. All in units of electrons/Bohr, profile difference enlarged by a factor of 10.</table>

International Scholarly Research Notices

fig6

Figure 6

Figure 6: LDA and GGA Investigations of Some Ground-State Properties and the Compton Profile of Copper with the All-Electron MAPW Method 