Re: [Ifeffit] DAFS calculation

2016-01-21 Thread Matt Newville
t; > Date: Sat, 16 Jan 2016 14:49:09 -0500 > > Subject: Re: [Ifeffit] DAFS calculation > > > > > > > No version of Atoms has ever done anything more than simple simulations > > intended to help plan a DAFS measurement. > > > > To my knowledge, there is

Re: [Ifeffit] DAFS calculation

2016-01-20 Thread JeongEunSuk
t, 16 Jan 2016 14:49:09 -0500 > Subject: Re: [Ifeffit] DAFS calculation > > > No version of Atoms has ever done anything more than simple simulations > intended to help plan a DAFS measurement. > > To my knowledge, there is no general purpose software for DAFS that is &g

Re: [Ifeffit] DAFS calculation

2016-01-16 Thread Bruce Ravel
No version of Atoms has ever done anything more than simple simulations intended to help plan a DAFS measurement. To my knowledge, there is no general purpose software for DAFS that is widely available. I certainly haven't written any. That said, Larch has a lot of the tools you'd need to

[Ifeffit] DAFS calculation

2016-01-14 Thread JeongEunSuk
Hello I've heard that Atoms 3.0 code is available to calculate DAFS. I would like to calculate it. Do you have any example for it? I don't know how to use keywords in Atoms 3.0 such as dafs, emin, emax and others. Best regards Eun-Suk Jeong _