prt_lines_molecules.cpp

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/* This file is part of Cloudy and is copyright (C)1978-2017 by Gary J. Ferland and
 * others.  For conditions of distribution and use see copyright notice in license.txt */
/*lines_molecules put energetics, H, and He lines into line intensity stack */
#include "cddefines.h"
#include "coolheavy.h"
#include "thermal.h"
#include "dense.h"
#include "hmi.h"
#include "phycon.h"
#include "h2.h"
#include "co.h"
#include "radius.h"
#include "lines.h"
#include "lines_service.h"
#include "mole.h"

void lines_molecules(void)
{
        long int i;

        DEBUG_ENTRY( "lines_molecules()" );

        /* molecules */
        i = StuffComment( "molecules" );
        linadd( 0., (realnum)i , "####", 'i',
                "  molecules");


        /* >>refer      H2      rot     Lepp, S., & Shull, J.M., 1983, ApJ, 270, 578-582
         * roughly two microns */
        linadd(CoolHeavy.h2line,20000.,"H2 l",'c', 
                   "cooling due H2 rotation lines from simple model" );
        /* remember largest fraction of H2 cooling for possible comment */
        hmi.h2line_cool_frac = (realnum)MAX2( CoolHeavy.h2line/thermal.ctot , hmi.h2line_cool_frac );

        /* HD rotation cooling */
        linadd(CoolHeavy.HD,0,"HDro",'c',
                "HD rotation cooling");

        /* molecular hydrogen heating */
        hmi.h2dtot += (realnum)(hmi.HeatH2Dish_used*radius.dVeffAper);
        hmi.h2dfrc = (realnum)(MAX2(safe_div(hmi.HeatH2Dish_used,thermal.htot,0.0),hmi.h2dfrc));

        /* largest fraction of heating due to photo dissoc of H2+ */
        hmi.h2pmax = MAX2(hmi.h2pmax,(realnum)(safe_div(thermal.heating(0,16),thermal.htot,0.0)));

        linadd(hmi.HeatH2Dish_used,0,"H2dH",'h',
                "heating by H2 dissociation by photons and cosmic rays");

        /*remember largest fraction of heating due to H2 vib deexcitation */    
        hmi.HeatH2DexcMax = MAX2(safe_div((realnum)hmi.HeatH2Dexc_used,(realnum)thermal.htot,(realnum)0.0f),hmi.HeatH2DexcMax);

        /*remember largest fraction of cooling due to H2 cooling */
        hmi.CoolH2DexcMax = MAX2(safe_div(-(realnum)hmi.HeatH2Dexc_used,(realnum)thermal.htot,(realnum)0.0f),hmi.CoolH2DexcMax);

        linadd( MAX2(0.,hmi.HeatH2Dexc_used),0,"H2vH",'h',
                "heating by coll deexcit of vib-excited H2");

        linadd( MAX2(0.,-hmi.HeatH2Dexc_used) ,0,"H2vC",'c',
                " cooling by coll deexcit of vib-excited H2");

        /* line emission by vib-excited H2 */
        if( h2.lgEnabled )
        {

                linadd( 0. ,0,"H2 v",'i',
                        "  when large molecule is turned on do not print this simple estimate  line emission by vib-excited H2 ");
        }
        else
        {
                linadd( findspecieslocal("H2*")->den*2e-7*4.17e-12,0,"H2 v",'i',
                        " H2 vib-excited lines from Tielens & Hollenbach 1985");
        }

        /* add in explicit lines from the large H2 molecule 
         * routine in mole_h2_io.c */
        for( diatom_iter diatom = diatoms.begin(); diatom != diatoms.end(); ++diatom )
                (*diatom)->H2_LinesAdd();

        // the line blend, mostly the last, 1-0 S(0)
        LinSv *Blnd = linadd(0.0,21210,"Blnd",'i',"Blend" );
        if( h2.lgEnabled )
        {
                Blnd->addComponent("H2  ",21205.7);
                Blnd->addComponent("H2  ",21209.9);
                Blnd->addComponent("H2  ",21212.5);
        }

        linadd(hmi.hmicol,0,"H-FB",'c',
                "        neg H ion free-bound emission, H + e -> H- + hnu ");

        linadd(CoolHeavy.brems_cool_hminus,0,"H-FF",'i',
                " neg H ion free-free emission ");

        /* H-alpha produced by H- mutual neutralization */
        linadd(mole.findrate("H-,H+=>H,H")*3.032e-12,6562.85,"H-CT",'i',
                "  H-alpha produced by H- mutual neutralization ");

        /* remember total heating */
        hmi.hmitot += hmi.hmihet*radius.dVeffAper;

        linadd(MAX2(0.,hmi.hmihet),0,"H- H",'h',
                "  H- heating ");

        linadd(MAX2(0.,-hmi.hmihet),0,"H-Hc",'c',
                "  induced H- cooling ");

        linadd(CoolHeavy.H2PlsCool,0,"H2+ ",'c',
                "  H+ + H => H2+ + photon continuum cooling ");

        linadd(hmi.h2plus_heat,0,"H2+p",'h',
                "  H2+ photo dissoc heating ");

        linadd(MAX2(3.27e-12+phycon.te*BOLTZMANN,0.)*dense.xIonDense[ipHYDROGEN][1]*dense.xIonDense[ipHELIUM][0]*1e-20+
          (1.76e-11+phycon.te*BOLTZMANN)*dense.xIonDense[ipHYDROGEN][0]*dense.xIonDense[ipHELIUM][1]*1e-16,0,"HEH+",'i' ,
          "  HeH+ formation cooling ");

        /* carbon monoxide heating */
        co.codtot += co.CODissHeat*(realnum)radius.dVeffAper;
        co.codfrc = (realnum)MAX2(safe_div((double)co.CODissHeat,thermal.htot,0.0),co.codfrc);

        linadd(co.CODissHeat,0,"COdh",'h',
                "  carbon monoxide co photodissociation ");

        return;
}