Code |
c
c###################################################################
c
subroutine heexcen(n, l, mult, sumen, eexc, kermsg)
c
c this subroutine passes the excitation energy for excited states
c of helium taken from tables a.4 and a.5 given by janev et al.
c (see doc=h-he-plasma.)
c
c the input subroutine parameters are
c
c n = principal quantum number of the excited electronic state
c
c l = orbital angular momentum quantum number of the exited state
c
c mult = the spin multiplicity (2s+1) of the state
c
c sumen = indicates choice of excitation enegy to be returned.
c if sumen=0 the excitation energy for the specific
c state (quantified by n, l amd mult) is returned
c if sumen=1 the excitation energy taken as an average
c over angular momentum and toatal spin is returned
c
c the output subroutine parameters are
c
c eexc = excitation energy
c
c kermsg = blank if no errors
c
c written by j. j. smith , iaea atomic and molecular data unit
c
c------------------------------------------------------------------------
c
character*(*) kermsg
integer n, l, mult, sumen, lp, multp
dimension enl(4,4,2), en(7)
data (((enl(i,j,k),i=1,4),j=1,4),k=1,2) /32*0.0/
c
c---- n=1 state
c
c data enl(1,1,1)
c * / 24.588 /,
c
c---- n=2 excited states
c
c 1 enl(2,1,1),enl(2,1,2),enl(2,2,1),enl(2,2,2)
c * / 20.614, 19.818, 21.217, 20.963 /,
c
c---- n=3 excited states
c
c 2 enl(3,1,1),enl(3,1,2),enl(3,2,1),enl(3,2,2),enl(3,3,1),
c * enl(3,3,2)
c * / 22.919, 22.717, 23.086, 23.006, 23.073, 23.072 /,
c
c---- n=4 excited states
c
c 3 enl(4,1,1),enl(4,1,2),enl(4,2,1),enl(4,2,2),enl(4,3,1),
c * enl(4,3,2),enl(4,4,1),enl(4,4,2)
c * / 23.672, 23.529, 23.741, 23.706, 23.735, 23.735, 23.736,
c * 23.736 /
c
c----- excitation energies summed over angular momentum and
c----- total spin
c
enl(1,1,1)=24.588
c---- n=2 excited states
enl(2,1,1)=20.614
enl(2,1,2)=19.818
enl(2,2,1)=21.217
enl(2,2,2)=20.963
c---- n=3 excited states
enl(3,1,1)=22.919
enl(3,1,2)=22.717
enl(3,2,1)=23.086
enl(3,2,2)=23.006
enl(3,3,1)=23.073
enl(3,3,2)=23.072
c---- n=4 excited states
enl(4,1,1)=23.672
enl(4,1,2)=23.529
enl(4,2,1)=23.741
enl(4,2,2)=23.706
enl(4,3,1)=23.735
enl(4,3,2)=23.735
enl(4,4,1)=23.736
enl(4,4,2)=23.736
data (en(k),k=1,2) /2*0.0/
data en(3),en(4),en(5),en(6),en(7)
* / 22.9799 , 23.699, 24.07, 24.30, 24.71/
c
kermsg =' '
if (sumen .eq. 1 .or. n .gt. 4) then
if (n .ge. 8) then
eexc =enl(1,1,1) - 13.58/(n*n)
return
else
eexc =en(n)
if (eexc .eq. 0.0) kermsg =
* 'excitation energy for n value not in table in heexcen'
endif
else
lp = l+1
if (mult .eq. 1) then
multp = 1
else if (mult .eq. 3) then
multp = 2
else
kermsg = 'invalid spin multipclity as input in heexcen'
endif
eexc = enl(n,lp,multp)
if (eexc .eq. 0.0) kermsg =
* 'excitation energy not in table in heexcen'
endif
return
end
c##################################################################
c
c###################################################################
c
subroutine heionen(n, l, mult, sumen, eion, kermsg)
c
c this subroutine passes the ionization energy for excited states
c of helium taken from tables a.4 and a.5 given by janev et al.
c (see doc=h-he-plasma.)
c
c the input subroutine parameters are
c
c n = principal quantum number of the excited electronic state
c
c l = orbital angular momentum quantum number of the exited state
c
c mult = the spin multiplicity (2s+1) of the state
c
c sumen = indicates choice of ionization energy to be returned.
c if sumen=0 the ionization energy for the specific
c state (quantified by n, l amd mult) is returned
c if sumen=1 the ionization energy taken as an average
c over angular momentum and toatal spin is returned
c
c the output subroutine parameters are
c
c eion = ionization energy
c
c kermsg = blank if no errors
c
c written by j. j. smith , iaea atomic and molecular data unit
c
c------------------------------------------------------------------------
c
character*(*) kermsg
integer n, l, mult, sumen, lp, multp
dimension enl(4,4,2), en(7)
data (((enl(i,j,k),i=1,4),j=1,4),k=1,2) /32*0.0/
c
c data enl(1,1,1)
c * / 24.588 /,
c
c---- n=2 excited states
c
c 1 enl(2,1,1),enl(2,1,2),enl(2,2,1),enl(2,2,2)
c * / 3.973, 4.769, 3.371, 3.625 /,
c
c---- n=3 excited states
c
c 2 enl(3,1,1),enl(3,1,2),enl(3,2,1),enl(3,2,2),enl(3,3,1),
c * enl(3,3,2)
c * / 1.699, 1.871, 1.502, 1.582, 1.515, 1.515 /,
c
c---- n=4 excited states
c
c 3 enl(4,1,1),enl(4,1,2),enl(4,2,1),enl(4,2,2),enl(4,3,1),
c * enl(4,3,2),enl(4,4,1),enl(4,4,2)
c * / 0.9155, 0.9951, 0.8470, 0.8812, 0.8529, 0.8530, 0.8520,
c * 0.8520 /
c
c----- ionization energies summed over angular momentum and
c----- total spin
c
data (en(k),k=1,2) /2*0.0/
data en(3),en(4),en(5),en(6),en(7)
* / 1.609 , 0.8811, 0.52, 0.37, 0.29/
c
enl(1,1,1)=24.588
c---- n=2 excited states
enl(2,1,1)=3.973
enl(2,1,2)=4.769
enl(2,2,1)=3.371
enl(2,2,2)=3.625
c---- n=3 excited states
enl(3,1,1)=1.699
enl(3,1,2)=1.871
enl(3,2,1)=1.502
enl(3,2,2)=1.582
enl(3,3,1)=1.515
enl(3,3,2)=1.515
c---- n=4 excited states
enl(4,1,1)=0.9155
enl(4,1,2)=0.9951
enl(4,2,1)=0.8470
enl(4,2,2)=0.8812
enl(4,3,1)=0.8529
enl(4,3,2)=0.8530
enl(4,4,1)=0.8520
enl(4,4,2)=0.8520
kermsg =' '
if (sumen .eq. 1) then
if (n .ge. 8) then
eion =13.58/(n*n)
return
else
eion =en(n)
if (eion .eq. 0.0) kermsg =
* 'ionization energy for n value not in table in heionen'
endif
else
lp = l+1
if (mult .eq. 1) then
multp = 1
else if (mult .eq. 3) then
multp = 2
else
kermsg = 'invalid spin multipclity as input in heionen'
endif
eion = enl(n,lp,multp)
if (eion .eq. 0.0) kermsg =
* 'ionization energy not in table in heionen'
endif
return
end
c###################################################################
c
c###################################################################
c
subroutine jeexc3(pe, pcf, kncf, pxs, kermsg)
c
c this is a subroutine to calculate a cross section
c in cm[2] as function of electron energy in ev for dipole
c forbidden transitions with spin change.
c for details see doc=h-he-plasma , used for reactions 2.3.3
c spin changing transitions only
c
c pcf is the coefficient data array, where
c
c pcf(1) = coefficient a
c
c pcf(2) = coefficient b
c
c pcf(3) = n, the principal quantum number of the final state
c
c pcf(4) = l, the angular momentum of the the final state
c
c - warning- .
c
c the coefficient array pcf is updated by this routine to
c include energy independent constants. these coefficients can be
c used in subsequent calls for the same entry. the coefficeients
c added are:
c
c pcf(5) = threshold excitation energy for the transition (ev)
c
c pcf(6) = ionization energy of the state
c
c pe = electron energy (ev)
c
c kermsg = blank if no errors
c
c pxs = cross section in cm[2]
c
c written by j. j. smith , iaea atomic and molecular data unit
c modified by d. humbert, 11 March 2008: n <==> l
c
c------------------------------------------------------------------------
c
double precision pe, pcf, pxs
double precision u3, u5, u9, u, nstar, bc
integer n, l
dimension pcf(6)
character*(*) kermsg
data ry/13.58/
a= pcf(1)
b = pcf(2)
n = pcf(4)
l = pcf(3)
c
kermsg = ' '
if (kncf .lt. 5) then
c
c first call to jeexc3 determine energy independent
c parameters and place in pcf for further use
c
c determine the excitation energy of the final state
c
call heexcen (n, l, 3, 0, eexc, kermsg)
if (kermsg .ne. ' ') return
c
c determine the ionization energy of the final state
c
call heionen (n, l, 3, 0, eion, kermsg)
if ( kermsg .ne. ' ') return
c
c place energy independent parameters in coefficient array and
c update kncf
c
pcf(5) = eexc
pcf(6) = eion
kncf = 6
c
else if (kncf .eq. 6) then
eexc = pcf(5)
eion = pcf(6)
c
else
kermsg = ' incorrect number of coefficients passed to jeexc3'
return
endif
c
if (n .ge. 4) then
nstar = sqrt(ry/eion)
ac = a /(n**3)
else
ac = a
endif
c
if (pe .lt. eexc) then
pxs = 0.0
return
endif
c
u = pe / eexc
u3 = u**3
u5 = u**5
u9 = u**9
c
if (b .gt. 0.0) then
bc = b/u9
else
bc = 0.0
endif
c
pxs = 3.52e-16 * ( ac * (1.0/u3 - 1.0/u5) + bc )
c
return
c
end |