Text only | Text with Images

iRASPA Community

iRASPA => General => Topic started by: Mohammad Ahmadi on April 15, 2022, 03:20:34 PM

Poll
Question: How to get the cif files of the XRD?
Option 1: Hi dear Prof. Dubbeldam votes: 1
Option 2: would you please guide me on how can I convert the XRD test to CIF file votes: 0
Title: CIF file
Post by: Mohammad Ahmadi on April 15, 2022, 03:20:34 PM
Hi dear Prof. Dubbeldam
would you please guide me on how can I convert the XRD test to CIF file
Title: Re: CIF file
Post by: David Dubbeldam on April 18, 2022, 07:43:09 PM
CIF files are published by experimental groups to convert the structural data in a standardized way. The are uploaded to databases like CSD database.
For simulation codes, the atomic information is necessary _input_ for the simulations, because the positions of all the atoms need to be specified.
Programs like 'Openbabel' can convert between many formats.
Title: Re: CIF file
Post by: pooja7191 on September 14, 2026, 11:30:47 AM
fgdhfgkjl;'
Title: Re: CIF file
Post by: pooja7191 on September 22, 2026, 08:19:04 AM
Make your special events even more memorable by adding the dazzling presence of a charming Model Call Girl in Delhi (https://www.modelescortindelhi.in/) to your VIP guest list.
Text only | Text with Images