AMICA, an r12-MR-CI program system

From: Robert Gdanitz <gdanitz |-at-| thcpch.nat.tu-bs.de>
Subject: AMICA, an r12-MR-CI program system
Date: Mon, 13 Nov 2000 17:54:49 +0100 (MET)

Dear Colleagues:
 I would like to draw your attention to a new program system called
 "AMICA."
 AMICA stands for "Atoms & Molecules in Chemical Accuracy." The
 program is
 capable of performing multi-reference (MR) configuration interaction (CI) like
 calculations including terms that are linear in the interelectronic distances.
 It features:
  o a user-friendly interface
  o a basis set library
  o r12-MR-ACPF, -AQCC, -CEPA-0, -CI and CPF (only single-reference without r12
    terms) calculations
  o tuned code for Compaq-Alpha (OSF1), NEC (Super-UX), and SGI (Irix)
 AMICA is freely available (for members of non-profit organizations) from
 http://www.tu-bs.de/~gdanitz/amica. For a short description
 of the method and
 access to the manual, see: http://www.tu-bs.de/~gdanitz/#r12-CI.
 Please direct possible questions to: gdanitz.tu-bs.de.
 Regards, Robert
 --
 Dr. Robert J. Gdanitz
 Assistant Research Professor   Privatdozent for Theoretical Physics
 Department of Chemistry        Institute for Physical and Theoretical Chemistry
 Salt Lake City                 Technical University, Hans-Sommer-Str. 10
 Utah 84112-0850, USA           D-38106 Braunschweig, Germany