From 69751c0c4f0321719a3b68ad28f3ef86e73ef088 Mon Sep 17 00:00:00 2001 From: Karl Berry Date: Sun, 10 Nov 2013 22:42:13 +0000 Subject: bohr (10nov13) git-svn-id: svn://tug.org/texlive/trunk@32118 c570f23f-e606-0410-a88d-b1316a301751 --- Master/texmf-dist/doc/latex/bohr/README | 4 +- Master/texmf-dist/doc/latex/bohr/bohr_en.pdf | Bin 429030 -> 434485 bytes Master/texmf-dist/doc/latex/bohr/bohr_en.tex | 80 +++++++++++++++++++++------ 3 files changed, 64 insertions(+), 20 deletions(-) (limited to 'Master/texmf-dist/doc/latex/bohr') diff --git a/Master/texmf-dist/doc/latex/bohr/README b/Master/texmf-dist/doc/latex/bohr/README index 0393d2d5081..c6176a24d51 100644 --- a/Master/texmf-dist/doc/latex/bohr/README +++ b/Master/texmf-dist/doc/latex/bohr/README @@ -1,9 +1,9 @@ -------------------------------------------------------------------------- -the BOHR package v0.3 +the BOHR package v0.4 simple atom representation according to the Bohr model -2013/11/05 +2013/11/10 -------------------------------------------------------------------------- Clemens Niederberger Web: https://bitbucket.org/cgnieder/bohr/ diff --git a/Master/texmf-dist/doc/latex/bohr/bohr_en.pdf b/Master/texmf-dist/doc/latex/bohr/bohr_en.pdf index 59af9fe18e1..0581d8f075e 100644 Binary files a/Master/texmf-dist/doc/latex/bohr/bohr_en.pdf and b/Master/texmf-dist/doc/latex/bohr/bohr_en.pdf differ diff --git a/Master/texmf-dist/doc/latex/bohr/bohr_en.tex b/Master/texmf-dist/doc/latex/bohr/bohr_en.tex index 3802ad3ed9c..1cf7d6bbb40 100644 --- a/Master/texmf-dist/doc/latex/bohr/bohr_en.tex +++ b/Master/texmf-dist/doc/latex/bohr/bohr_en.tex @@ -53,9 +53,13 @@ DeclareAtomName, DeclareAtomSymbol, DeclareElectronDistribution, + elconf, elementname, elementsymbol, + setatomname,setatomsymbol, + setelectrondistribution, setbohr, + writeelconf, Z } , add-silent-cmds = ch , @@ -213,25 +217,67 @@ There is not much more to it. Another example using the optional argument: \bohr{6}{} \bohr{}{K} \end{example} +\setbohr{atom-style = \ch} + \section{Additional Commands}\label{sec:additional-commands} \BOHR\ provides some additional commands that return the element symbol or the element name to a given atomic number and vice versa. \begin{commands} - \command{elementsymbol}[\code{\{\choices{\meta{atomic number},\meta{element name}}\}}] - Returns the element symbol for a given atomic number or element name. - \verbcode+\elementsymbol{80}+: \elementsymbol{80}; - \verbcode+\elementsymbol{rhenium}+: \elementsymbol{rhenium}. - \command{elementname}[\code{\{\choices{\meta{atomic number}|\meta{element symbol}}\}}] - Returns the element name for a given atomic number or element symbol. - \verbcode+\elementname{80}+: \elementname{80}; + \command{elementsymbol}[\Marg{\choices{\meta{atomic number},\meta{element + name}}}] + Returns the element symbol for a given atomic number or element name.\\ + \verbcode+\elementsymbol{80}+: \elementsymbol{80};\\ + \verbcode+\elementsymbol{rhenium}+: \elementsymbol{rhenium}.\\ + The symbols are printed according to \option{atom-style}. + \command{elementname}[\Marg{\choices{\meta{atomic number},\meta{element + symbol}}}] + Returns the element name for a given atomic number or element symbol.\\ + \verbcode+\elementname{80}+: \elementname{80};\\ \verbcode+\elementname{Rh}+: \elementname{Rh}. - \command{atomicnumber}[\code{\{\choices{\meta{element name}|\meta{element symbol}}\}}] - Returns the atomic number for a given element name or element symbol. - \verbcode+\atomicnumber{Hg}+: \atomicnumber{Hg}; + \command{atomicnumber}[\Marg{\choices{\meta{element name},\meta{element + symbol}}}] + Returns the atomic number for a given element name or element symbol.\\ + \verbcode+\atomicnumber{Hg}+: \atomicnumber{Hg};\\ \verbcode+\atomicnumber{rhenium}+ \atomicnumber{rhenium}. \command{Z} - If this command isn't defined by some other package it is available as an + If this command isn't defined at begin document it is available as an alias of \cs{atomicnumber}. + \command{elconf}[\Marg{\choices{\meta{atomic number},\meta{element + symbol},\meta{element name}}}] + \sinceversion{0.4}Prints the electron configuration of the given + element.\\ + \verbcode+\elconf{Cu}+: \elconf{Cu};\\ + \verbcode+\elconf{copper}+: \elconf{copper};\\ + \verbcode+\elconf{29}+: \elconf{29}.\\ + Currently there is no way to get the shortened version + (\eg\ $[\elementsymbol{18}]3d^{10}4s^1$ for \elementname{29}). + \command{writeelconf}[\marg{electron distribution}] + \sinceversion{0.4}Writes the electron distribution \meta{electron + distribution}. The input is the same as described below for + \cs{setelectrondistribution}.\\ + \verbcode=\writeelconf{2,2+6,2+6+7}=: \writeelconf{2,2+6,2+6+7}. + \command{setatomsymbol}[\marg{atomic number}\marg{atom symbol}] + \sinceversion{0.4}This sets the symbol associated with the atom number + \meta{atomic number}. + \command{setatomname}[\marg{atomic number}\marg{element name}] + \sinceversion{0.4}This sets the element name associated with the atom + number \meta{atomic number}. + \command{setelectrondistribution}[\marg{atomic number}\marg{electron + distribution}] + \sinceversion{0.4}This set the electron distribution associated with the + atom number \meta{atomic number}. \meta{electron distribution} is a + comma-separated list of the number of electrons placed on each shell from + inner to outer shell. For example + \verbcode+\setelectrondistribution{3}{2,0,1}+ would be an excited + Lithium. The distribution thus declared is only used for drawing when + \keyis{distribution-method}{quantum} but is also used by \cs{elconf}. The + number of electrons with the same principal quantum number but a different + angular quantum number are separated with a \code{+} ordered by the + angular quantum number, \ie, first $s$, then $p$, then $d$, and then $f$. + \elementname{29}'s distribution would be declared like this: + \verbcode=\setelectrondistribution{29}{2,2+6,2+6+10,1}=.\par + A declaration with \verbcode=\setelectrondistribution{29}{2,8,18,1}= would + work but then \cs{elconf}\Marg{29} would give the wrong results. \end{commands} \begin{example} @@ -245,22 +291,20 @@ The element properties used by \BOHR\ are defined through the following commands \command{DeclareAtomSymbol}[\marg{atomic number}\marg{atom symbol}] The package file contains 112~lines like the following: \verbcode+\DeclareAtomSymbol{29}{Cu}+. They associate atomic number with - the corresponding atom symbol. This command could be used to change an - element's symbol. + the corresponding atom symbol. This is the internal equivalent to + \cs{setatomsymbol}. \command{DeclareAtomName}[\marg{atomic number}\marg{element name}] \BOHR\ comes with a few language files named \code{bohr\_elements\_\meta{language}.def}. They contain of 112~entries like \verbcode+\DeclareAtomName{29}{Copper}+ which associate atomic number - and element name. This command could be used to change an element's name. + and element name. This is the internal equivalent to \cs{setatomname}. \command{DeclareElectronDistribution}[\marg{atomic number}\marg{electron distribution}] The \meta{electron distribution} is a comma separated list of integers which determines how the electrons are distributed on the shells when \keyis{distribution-method}{quantum}. The package file contains - 112~entries like \verbcode+\DeclareElectronDistribution{29}{2,8,18,1}+. - This command could be used to change an element's electron configuration. + 112~entries like \verbcode=\DeclareElectronDistribution{29}{2,2+6,2+6+10,1}=. + This is the internal equivalent to \cs{setelectrondistribution}. \end{commands} -\clearpage - \end{document} -- cgit v1.2.3