From chemistry-request@ccl.net Tue Jan 6 14:13:37 2004 Received: from mail.ic.sunysb.edu (mail.ic.sunysb.edu [129.49.1.4]) by server.ccl.net (8.12.8/8.12.8) with ESMTP id i06JD6X9006438 for ; Tue, 6 Jan 2004 14:13:06 -0500 Received: from postal.ic.sunysb.edu (mail [129.49.1.4]) by mail.ic.sunysb.edu (8.12.10/8.12.10) with SMTP id i06JCnLc016941; Tue, 6 Jan 2004 14:13:06 -0500 (EST) Received: from smtp.ic.sunysb.edu ([129.49.1.24]) by postal.ic.sunysb.edu (SAVSMTP 3.1.1.32) with SMTP id M2004010614130500324 ; Tue, 06 Jan 2004 14:13:05 -0500 Received: from sparky.ic.sunysb.edu (daemon-.at.-sparky.ic.sunysb.edu [129.49.1.3]) by smtp.ic.sunysb.edu (8.12.10/8.12.10) with ESMTP id i06JD6RM017061; Tue, 6 Jan 2004 14:13:06 -0500 (EST) Received: from localhost (yonyang@localhost) by sparky.ic.sunysb.edu (8.12.10/8.12.9) with ESMTP id i06JD5PA021429; Tue, 6 Jan 2004 14:13:05 -0500 (EST) Date: Tue, 6 Jan 2004 14:13:05 -0500 (EST) From: Yong Liang Yang To: chemistry-.at.-ccl.net cc: yonyang-.at.-ic.sunysb.edu Subject: Internal Coordinate Message-ID: MIME-Version: 1.0 Content-Type: TEXT/PLAIN; charset=US-ASCII X-Spam-Status: No, hits=0.0 required=7.0 tests=USER_AGENT_PINE version=2.55 X-Spam-Checker-Version: SpamAssassin 2.55 (1.174.2.19-2003-05-19-exp) Dear CCL users: Happy new year! A simple question, how can I convert other coordinate data into internal coordinate data, (especially, create internal coordinate input files for AMSOL or AMPAC calculation). And how can I visualize the internal coordinate results from AMSOL or AMPAC? Any suggestions are appreciated! Cheers Yong.L.Y. Dept. of Chemistry (o) 631-632-5796