Sent to CCL by: "senthil nathan" [zenthil03[-]yahoo.co.in]
In connection with my privious question, I want to do fragment analysis for particular system. My total chemical system is neutral, but its fragment is charged species. I have done a calculation for both the fragment files separatly and I have two TAPE21 file for my fragments. For total fragment analysis I want to read some basic results form TAPE21 fragment file. Now I am using ADF trial windows version, in this version TAPE21 file will be a binary result file. I want to do this fragment TAPE21 file as input file for total fragment analysis. I unable to convert this binary file as a ADF input file. Any one of you tell me a better solution for my problem.
thanking you inadvance
best wishes from