TY - GEN A1 - Schöffel, Klaus T1 - Computational Chemistry Software at ZIB. N2 - The following report intends to provide a survey over the computational chemistry molecular structure software installed on the supercomputers CRAY X-MP/216 and CRAY Y-MP2E/164 at ZIB. It shows what kind of problems can be tackled with the existing chemistry software, which covers a wide range of ab initio, semiempirical, molecular mechanics, and dynamics applications. T3 - ZIB-Report - TR-92-02 Y1 - 1992 UR - https://opus4.kobv.de/opus4-zib/frontdoor/index/index/docId/487 UR - https://nbn-resolving.org/urn:nbn:de:0297-zib-4879 ER -