From owner-chemistry@ccl.net Fri Dec 30 20:47:01 2011 From: "Yang Guo guoyang0123/a\gmail.com" To: CCL Subject: CCL: Exchange integrals between MOs Message-Id: <-46097-111230204336-27166-WoKUWJBQMOd5BtJBRK0JtQ*_*server.ccl.net> X-Original-From: Yang Guo Content-Type: multipart/alternative; boundary=001517475fcaeb4b0004b55979ff Date: Sat, 31 Dec 2011 09:43:28 +0800 MIME-Version: 1.0 Sent to CCL by: Yang Guo [guoyang0123 ~~ gmail.com] --001517475fcaeb4b0004b55979ff Content-Type: text/plain; charset=ISO-8859-1 You can emloy the two electron integrals and the MOs in .fchk to reconstruct exchange matrix. --001517475fcaeb4b0004b55979ff Content-Type: text/html; charset=ISO-8859-1
You can emloy the two electron integrals and the MOs in .fchk to reconstruct exchange matrix.
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