diff --git a/Cover_Letter/CoverLetter.tex b/Cover_Letter/CoverLetter.tex index 9005359..4b226ba 100644 --- a/Cover_Letter/CoverLetter.tex +++ b/Cover_Letter/CoverLetter.tex @@ -14,10 +14,10 @@ \justifying Please find enclosed our manuscript entitled \begin{quote} -\textit{``A Density-based Basis-Set Correction for Wave-function Theory''}, +\textit{``A Density-Based Basis-Set Correction For Wave-Function Theory''}, \end{quote} which we would like you to consider as a Letter in the \textit{Journal of Physical Chemistry Letters}. -This contribution fits nicely in the section \textit{``Spectroscopy and Photochemistry; General theory''} {\color{darkgreen}MG: are we sure of the section ?}. +This contribution fits nicely in the section \textit{``Spectroscopy and Photochemistry; General theory''}. One of the most fundamental drawbacks of conventional wave function methods is the slow convergence of energies and properties with respect to the one-electron basis set. As proposed by Kutzelnigg more than thirty years ago, one can introduce explicitly the interelectronic distance $r_{12}$ to significantly speed up the convergence. @@ -27,7 +27,7 @@ The present universal, density-based basis set incompleteness correction, which Our results clearly demonstrate that the present basis set correction recovers quintuple-$\zeta$ quality atomization and correlation energies with triple-$\zeta$ basis sets for a much cheaper computational cost compared to explicitly-correlated F12 methods. Because of the large impact of our work, we expect it to be of interest to a wide audience within the chemistry community and beyond. -We suggest Paola Gori-Giorgi, Tim Gould, David Tew and Seiichiro Ten-no as potential referees. +We suggest Paola Gori-Giorgi, Tim Gould, David Tew, Emmanuel Fromager and Seiichiro Ten-no as potential referees. This contribution has never been submitted in total nor in parts to any other journal, and has been seen and approved by all authors. We look forward to hearing from you soon. diff --git a/Manuscript/C2_VXZ.pdf b/Manuscript/C2_VXZ.pdf index 0f10073..49ffac3 100644 Binary files a/Manuscript/C2_VXZ.pdf and b/Manuscript/C2_VXZ.pdf differ diff --git a/Manuscript/F2_VXZ.pdf b/Manuscript/F2_VXZ.pdf index 883c30b..15a24dc 100644 Binary files a/Manuscript/F2_VXZ.pdf and b/Manuscript/F2_VXZ.pdf differ diff --git a/Manuscript/N2_VXZ.pdf b/Manuscript/N2_VXZ.pdf index b90a0e9..bd00734 100644 Binary files a/Manuscript/N2_VXZ.pdf and b/Manuscript/N2_VXZ.pdf differ diff --git a/Manuscript/O2_VXZ.pdf b/Manuscript/O2_VXZ.pdf index 7c0a83e..a7724b7 100644 Binary files a/Manuscript/O2_VXZ.pdf and b/Manuscript/O2_VXZ.pdf differ