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<div class="moz-cite-prefix">Dear Elif,</div>
<div class="moz-cite-prefix"><br>
</div>
<div class="moz-cite-prefix">On 2024-02-22 13:20, ELİF ANT BURSALI
wrote:<br>
</div>
<blockquote type="cite"
cite="mid:CAJyUToq=c-s2TaLGgyGZNhzAJq-XmKO1PzN848HW16fcHXniqw@mail.gmail.com">
<p class="MsoNormal"
style="margin:0cm 0cm 0.0001pt;text-align:justify;line-height:150%;font-size:11pt;font-family:Calibri,sans-serif"><span
style="font-size:12pt;line-height:150%;font-family:"Times New Roman",serif"
lang="EN-US">I need to obtain the COD number or
JCPDS card number by using the raw XRD data of a new
synthesized substance. Are these
two numbers the same? </span></p>
</blockquote>
No, they are not. COD and JCPDS (probably you mean PDF, teh Powder
Diffraction File) are different databases, not related to each other
(in fact, the PDF is commercial and closed, so we do not even have
access to it). Correspondingly the identifiers of the two databases
are different, they are in different name spaces so to speak.<br>
<blockquote type="cite"
cite="mid:CAJyUToq=c-s2TaLGgyGZNhzAJq-XmKO1PzN848HW16fcHXniqw@mail.gmail.com">
<p class="MsoNormal"
style="margin:0cm 0cm 0.0001pt;text-align:justify;line-height:150%;font-size:11pt;font-family:Calibri,sans-serif"><span
style="font-size:12pt;line-height:150%;font-family:"Times New Roman",serif"
lang="EN-US">How can I access these numbers? Can you help me
if I
send you the raw XRD data of my material?</span></p>
</blockquote>
Unfortunately, not. We do not offer a service to process or handle
raw diffraction data for researchers, at least not at the moment.<br>
<blockquote type="cite"
cite="mid:CAJyUToq=c-s2TaLGgyGZNhzAJq-XmKO1PzN848HW16fcHXniqw@mail.gmail.com">
<p class="MsoNormal"
style="margin:0cm 0cm 0.0001pt;text-align:justify;line-height:150%;font-size:11pt;font-family:Calibri,sans-serif"><span
style="font-size:12pt;line-height:150%;font-family:"Times New Roman",serif"
lang="EN-US"> I am in a very difficult situation. In order for
the
article to be published, I need to index the complex with the
JCPDS card
number. I have quite limited time. I'm sorry for taking up
your valuable time.
I'm looking forward to your response. Yours sincerely.</span></p>
<p class="MsoNormal"
style="margin:0cm 0cm 0.0001pt;text-align:justify;line-height:150%;font-size:11pt;font-family:Calibri,sans-serif"><span
style="font-size:12pt;line-height:150%;font-family:"Times New Roman",serif"
lang="EN-US"></span></p>
</blockquote>
<p>We do not accept raw powder diffraction traces to the COD. For
the data to be suitable for COD, one needs to solve the atomic
resolution structure, refine it (e.g. using the Rietveld method)
and the submit to the COD both the atomic coordinates of the model
and the original diffractograms.</p>
<p>The raw powder diffraction data can probably be deposited to the
PDF of the ICDD (<a class="moz-txt-link-freetext" href="https://www.icdd.com/">https://www.icdd.com/</a>), but you need to contact
them to find out what their requirements would be.</p>
<p>Alternatively, you can upload data to a generic repository like
Zenodo (<a class="moz-txt-link-freetext" href="https://zenodo.org/">https://zenodo.org/</a>) and get a DOI for it, but the data
will not undergo any peer review there and will be harder to find
(although it will be open).<br>
</p>
<p>Sincerely yours,<br>
Saulius<br>
</p>
<pre class="moz-signature" cols="72">--
Dr. Saulius Gražulis
Vilnius University Institute of Biotechnology, Saulėtekio al. 7
LT-10257 Vilnius, Lietuva (Lithuania)
mobile: (+370-684)-49802, (+370-614)-36366
</pre>
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