I am still very behind but hope is there. It is provided with online-help, a user manual/ tutorial, the 'Crystallography Open Database' (COD) as well as several sample files. albeit once :-) Now I that is kind of closed but not good enough for a paper, I am trying to focus on other parts of my PhD. DIAMOND is distributed as a self-extracting executable file (-Setup.exe). But it was good to know I possibly made what I tried to. I am no Crystal expert, so I couldn't waste more of my PhD time to attempt to make more.
#Mercury crystallography software online manual
I eventually found that there was a decent chance I obtained what I wanted but this was after 1 year of leaving the files and then revisiting being pleased but then again realising to reproduce it would be difficult and would need to send the sample for much higher resolution scans being a perovskite and this would only be able to be done at Diamond. Online help is available from the authors web site and a short hard copy manual is in the binder by users computers. In the end I just visually compared the positions and heights of the peaks. cif files I and other scans would need various other files or things. dat, I did this with ConvX or PowDLL, there was also CMPR that I used to load and save as other formats. OlexSys Ltd is a scientific software company providing State of the Art Crystallographic Software as well as the best Laboratory Chemicals Management there. raw file and then I converted that to either a. Yes I did thank you, The mercury powder pattern was saved as a.