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</o:shapelayout></xml><![endif]--></head><body lang=ZH-CN link=blue vlink=purple style='text-justify-trim:punctuation'><div class=WordSection1><p class=MsoPlainText><span lang=EN-US style='font-family:"Times New Roman","serif"'>Hello Everyone,<o:p></o:p></span></p><p class=MsoNormal><span lang=EN-US style='font-family:"Times New Roman","serif"'>I am using PME(4.05) to calculate the long-rang electrostatic interaction, but when I finished the<o:p></o:p></span></p><p class=MsoNormal><span lang=EN-US style='font-family:"Times New Roman","serif"'>Simulation, I found that I can’t get the result of energy of the part of </span><span style='font-family:宋体'>“</span><span lang=EN-US style='font-family:"Times New Roman","serif"'>fourier space</span><span style='font-family:宋体'>（</span><span lang=EN-US style='font-family:"Times New Roman","serif"'>long range part</span><span style='font-family:宋体'>）”</span><span lang=EN-US style='font-family:"Times New Roman","serif"'>. In other word</span><span style='font-family:宋体'>，</span><span lang=EN-US style='font-family:"Times New Roman","serif"'>there is only a congregation of energy of that named Coul. recip. Is there any way that I can get the energy of “group to group” of the “fourier space” ?<o:p></o:p></span></p><p class=MsoNormal><span lang=EN-US style='font-family:"Times New Roman","serif"'>Thanks!<o:p></o:p></span></p><p class=MsoNormal><span lang=EN-US> <o:p></o:p></span></p><p class=MsoNormal><span lang=EN-US> Li<o:p></o:p></span></p></div></body></html>