more shortcuts

[lectures/latex.git] / posic / publications / sic_prec_reply02.txt

diff --git a/posic/publications/sic_prec_reply02.txt b/posic/publications/sic_prec_reply02.txt
index 8734d3f..2aea833 100644 (file)
--- a/posic/publications/sic_prec_reply02.txt
+++ b/posic/publications/sic_prec_reply02.txt
@@ -21,7 +21,9 @@ thank you for the feedback to our submission.
 > response to all recommendations and criticisms.
 
 We decided to follow yours and the referee's suggestion to merge the
 > response to all recommendations and criticisms.
 
 We decided to follow yours and the referee's suggestion to merge the

-two manuscripts in a single comprehensive manuscript.
+two manuscripts in a single comprehensive manuscript. Also, according
+to the referee's suggestions, some points were clarified and explained
+in more detail.

 
 Please find below the summary of changes and a detailed response to
 the recommendations of the referee.
 
 Please find below the summary of changes and a detailed response to
 the recommendations of the referee.


@@ -125,20 +127,6 @@ simulations. Combinations of defects with similar distances were
 already successfully modeled in a supercell containing 216 atoms as
 described in PRB 66, 195214 (2002).
 
 already successfully modeled in a supercell containing 216 atoms as
 described in PRB 66, 195214 (2002).
 

-% We would like to remind the referee that the properties of isolated,
-% non-intertacting defects were modeled in separate simulation runs.  It
-% is not our purpose to separate defects by a large distance in order to
-% approximate the situation of isolated defects.  We are rather
-% interested in interacting defects. However, we did find that for
-% increasing defect distances, configurations appear, which converge to
-% the energetics of two isolated defects. This is indicated by the
-% (absolute value of the) binding energy, which is approaching zero with
-% increasing distance.  From this, we conclude a decrease in
-% interaction, which is already observable for defect separation
-% distances accessible in our simulations. Combinations of defects with
-% similar distances were already successfully modeled in a supercell
-% containing 216 atoms as described in PRB 66, 195214 (2002).
-

 An explanation of the binding energy and the relation to the
 interaction of defects was added (Change 8).
 
 An explanation of the binding energy and the relation to the
 interaction of defects was added (Change 8).
 


@@ -147,23 +135,15 @@ interaction of defects was added (Change 8).
 > are seen for constant volume calculations (on a few simple
 > examples, say)?
 
 > are seen for constant volume calculations (on a few simple
 > examples, say)?
 

-% Differences are supposed to be negligible small since only small
-% changes in volume are detected. However, in experiment, substrate
-% swelling is observed. Thus, to allow for full relaxation, simulations
-% were performed in the NpT ensemble. However, for the above-mentioned
-% reason, no fundamental differences are expected for single defect
-% configurations in the canonical and isothermal-isobaric ensemble with
-% respect to energy.
-

 In experiment, substrate swelling is observed for high-dose carbon
 implantation into silicon. Indeed, for a single defect, the change in
 volume is less than 0.2% in simulation. Due to this, results of single
 In experiment, substrate swelling is observed for high-dose carbon
 implantation into silicon. Indeed, for a single defect, the change in
 volume is less than 0.2% in simulation. Due to this, results of single

-defects within an isothermal-isobaric simulation are expected to not
-drastically differ to results of constant volume simulations. Based on the
-experimentally observed change in volume for high-dose carbon
+defects within an isothermal-isobaric simulation are not expected to
+differ drastically to results of constant volume simulations. Based on
+the experimentally observed change in volume for high-dose carbon

 implantations, however, the respective relaxation is allowed for in
 implantations, however, the respective relaxation is allowed for in

-simulation for both, single defect calulations as well as the high carbon
-concentration simulations.
+simulation for both, single defect calulations as well as the high
+carbon concentration simulations.

 
 A respective statement was added to the methodology section
 (Change 4).
 
 A respective statement was added to the methodology section
 (Change 4).


@@ -305,12 +285,12 @@ Description:
 + = line added
 - = line removed
 
 + = line added
 - = line removed
 

-Change 1: added/merged parts of the Abstract of BA11443
+Change 1: added/merged parts of 'Abstract' of BA11443

 
  from:  These aime to clarify ...
  until: Finally, results of the ...
 
 
  from:  These aime to clarify ...
  until: Finally, results of the ...
 

-Change 2: added/merged parts of the Introduction of BA11443
+Change 2: added/merged parts of 'Introduction' of BA11443

 
  from:  A lot of theoretical work has been done ...
  until: However, investigations are, first of all, ... 
 
  from:  A lot of theoretical work has been done ...
  until: However, investigations are, first of all, ... 


@@ -355,12 +335,12 @@ Change 7: CRT not necessarily predicts the minimum energy path
  structures.
 
 Change 8: added definition and explanation of the binding energy to
  structures.
 
 Change 8: added definition and explanation of the binding energy to

-          the methodology section
+          the 'Methodology' section

 
  from:  The binding energy of a defect pair ...
  until: The interaction strength, i.e. the ...
 
 
  from:  The binding energy of a defect pair ...
  until: The interaction strength, i.e. the ...
 

-Change 9: removed Results section
+Change 9: removed 'Results' section

 
 Change 10: added 'Comparison of classical potential and
            first-principles methods' section
 
 Change 10: added 'Comparison of classical potential and
            first-principles methods' section


@@ -409,8 +389,8 @@ Change 19: section 'Classical potential calculations on the SiC
  
  content corresponds to 'Results' section of BC11912
 
  
  content corresponds to 'Results' section of BC11912
 

-Change 20: 'Summary' section added containing parts of 'Discussion and
-            summary' section of BC11912
+Change 20: 'Summary of classical potential calculations' section added
+           containing parts of 'Discussion and summary' section of BC11912

 
 Change 21: 'Conclusions' section added containing parts of the
           'Discussion' section of BA11443 and the 'Discussion and
 
 Change 21: 'Conclusions' section added containing parts of the
           'Discussion' section of BA11443 and the 'Discussion and