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Dear Dr. XXX,

The above manuscript has been reviewed by our referees.

A critique drawn from the reports appears below.  On this basis, we judge that the paper is not appropriate for Physical Review Letters, but might be suitable for publication in another journal, possibly with some revision.  Therefore, we recommend that you submit your manuscript elsewhere.

Yours sincerely,

----------------------------------------------------------------------
Report of Referee A
----------------------------------------------------------------------

In this paper the authors present a thorough study of XXX¡­..

The presented study is careful and of high quality. It is also interesting and it could be very important if the formula that the authors propose is general enough to be used as a predictive tool to obtain XXX in general atomistic environments for any XXX of interest.

My feeling is that the paper should definitely be published though I am not completely convinced that the journal in which it should be published is Physical Review Letters.

However, if the authors address adequately the following points it could become possible to recommend its publication in PRL:
1)XXX
2)XXX

----------------------------------------------------------------------
Report of Referee B
----------------------------------------------------------------------

The manuscript by XXX presents a modeling study of XXX. A general formula is proposed to describe XXX.
My main concern with the proposed model is its generality. The authors indicate that the model is general, but it has only been demonstrated for XXX. It is not clear whether this model applies to XXX. I think the applicability of this model to other XXX is unlikely, given that the XXX would be significantly more complicated than that of XXX. This limits the generality and overall impact of the proposed model. Overall, the proposed model is interesting and novel, but may be more appropriate for a specialized journal due to its limited applicability. The rich information in the supplementary information should also be included into the main text as a regular article, which is probably more appropriate for this study.
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