59 lines
3.7 KiB
TeX
59 lines
3.7 KiB
TeX
\relax
|
|
\providecommand\hyper@newdestlabel[2]{}
|
|
\providecommand\HyperFirstAtBeginDocument{\AtBeginDocument}
|
|
\HyperFirstAtBeginDocument{\ifx\hyper@anchor\@undefined
|
|
\global\let\oldcontentsline\contentsline
|
|
\gdef\contentsline#1#2#3#4{\oldcontentsline{#1}{#2}{#3}}
|
|
\global\let\oldnewlabel\newlabel
|
|
\gdef\newlabel#1#2{\newlabelxx{#1}#2}
|
|
\gdef\newlabelxx#1#2#3#4#5#6{\oldnewlabel{#1}{{#2}{#3}}}
|
|
\AtEndDocument{\ifx\hyper@anchor\@undefined
|
|
\let\contentsline\oldcontentsline
|
|
\let\newlabel\oldnewlabel
|
|
\fi}
|
|
\fi}
|
|
\global\let\hyper@last\relax
|
|
\gdef\HyperFirstAtBeginDocument#1{#1}
|
|
\providecommand\HyField@AuxAddToFields[1]{}
|
|
\providecommand\HyField@AuxAddToCoFields[2]{}
|
|
\citation{bally_cyclobutadiene_1980}
|
|
\citation{noauthor_aromaticity_nodate}
|
|
\citation{baeyer_ueber_1885}
|
|
\citation{reeves_further_1969}
|
|
\citation{irngartinger_bonding_1983,ermer_three_1983,kreile_uv_1986}
|
|
\bibdata{CBDNotes,CBD}
|
|
\bibcite{bally_cyclobutadiene_1980}{{1}{}{{Bally and Masamune}}{{Bally, and Masamune}}}
|
|
\bibcite{noauthor_aromaticity_nodate}{{2}{}{{noa}}{{}}}
|
|
\bibcite{baeyer_ueber_1885}{{3}{}{{Baeyer}}{{}}}
|
|
\newlabel{FirstPage}{{}{1}{}{section*.1}{}}
|
|
\@writefile{toc}{\contentsline {title}{Reference energies for cyclobutadiene}{1}{section*.2}\protected@file@percent }
|
|
\@writefile{toc}{\contentsline {abstract}{Abstract}{1}{section*.1}\protected@file@percent }
|
|
\@writefile{toc}{\contentsline {section}{\numberline {I}Introduction}{1}{section*.3}\protected@file@percent }
|
|
\newlabel{sec:intro}{{I}{1}{}{section*.3}{}}
|
|
\@writefile{lof}{\contentsline {figure}{\numberline {1}{\ignorespaces Here comes the caption of the figure.}}{1}{figure.1}\protected@file@percent }
|
|
\newlabel{fig:CBD}{{1}{1}{Here comes the caption of the figure}{figure.1}{}}
|
|
\@writefile{toc}{\contentsline {section}{\numberline {II}Computational methods}{1}{section*.4}\protected@file@percent }
|
|
\newlabel{sec:compdet}{{II}{1}{}{section*.4}{}}
|
|
\@writefile{toc}{\contentsline {subsection}{\numberline {A}CIPSI}{1}{section*.5}\protected@file@percent }
|
|
\newlabel{sec:CIPSI}{{II\tmspace +\thinmuskip {.1667em}A}{1}{}{section*.5}{}}
|
|
\@writefile{toc}{\contentsline {subsection}{\numberline {B}Coupled-Cluster}{1}{section*.6}\protected@file@percent }
|
|
\newlabel{sec:CC}{{II\tmspace +\thinmuskip {.1667em}B}{1}{}{section*.6}{}}
|
|
\@writefile{toc}{\contentsline {subsection}{\numberline {C}CASPT2/NEVPT2}{1}{section*.7}\protected@file@percent }
|
|
\newlabel{sec:CAS}{{II\tmspace +\thinmuskip {.1667em}C}{1}{}{section*.7}{}}
|
|
\@writefile{toc}{\contentsline {subsection}{\numberline {D}Spin-Flip}{1}{section*.8}\protected@file@percent }
|
|
\newlabel{sec:sf}{{II\tmspace +\thinmuskip {.1667em}D}{1}{}{section*.8}{}}
|
|
\@writefile{toc}{\contentsline {section}{\numberline {III}Results and discussion}{1}{section*.9}\protected@file@percent }
|
|
\newlabel{sec:res}{{III}{1}{}{section*.9}{}}
|
|
\@writefile{toc}{\contentsline {subsection}{\numberline {A}Excited States}{1}{section*.10}\protected@file@percent }
|
|
\@writefile{toc}{\contentsline {subsection}{\numberline {B}Automerization}{1}{section*.11}\protected@file@percent }
|
|
\@writefile{toc}{\contentsline {section}{\numberline {IV}Conclusion}{1}{section*.12}\protected@file@percent }
|
|
\newlabel{sec:res}{{IV}{1}{}{section*.12}{}}
|
|
\@writefile{toc}{\contentsline {section}{\numberline {}Acknowledgments}{1}{section*.13}\protected@file@percent }
|
|
\bibcite{reeves_further_1969}{{4}{}{{Reeves et~al.}}{{Reeves, Henery, and Pettit}}}
|
|
\bibcite{irngartinger_bonding_1983}{{5}{}{{Irngartinger and Nixdorf}}{{Irngartinger, and Nixdorf}}}
|
|
\bibcite{ermer_three_1983}{{6}{}{{Ermer and Heilbronner}}{{Ermer, and Heilbronner}}}
|
|
\bibcite{kreile_uv_1986}{{7}{}{{Kreile et~al.}}{{Kreile, Münzel, Schweig, and Specht}}}
|
|
\bibstyle{achemso}
|
|
\newlabel{LastBibItem}{{7}{2}{}{section*.13}{}}
|
|
\newlabel{LastPage}{{}{2}{}{}{}}
|