Lemen 1986
Lemen 1986
Lemen 1986
When does the non-variational nature of second-order Møller-Plesset energies manifest itself? All-electron
correlation energies for open-shell atoms from K to Br
J. Chem. Phys. 136, 054107 (2012); 10.1063/1.3679969
The geometric, electronic, and magnetic properties of Ag 5 X + ( X = Sc , Ti, V, Cr, Mn, Fe, Co, and Ni) clusters
J. Chem. Phys. 124, 184319 (2006); 10.1063/1.2191495
High-current vacuum-arc ion and plasma source “Raduga-5” application to intermetallic phase formation
Rev. Sci. Instrum. 77, 03C115 (2006); 10.1063/1.2170037
Soft x-ray reflectivity and structure evaluation of Ni/Ti and Ni-N/Ti-N multilayers
AIP Conf. Proc. 507, 714 (2000); 10.1063/1.1291238
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Inner-shen x-ray Une spectra of highly ionized titanium, chromium, iron,
and nickel and their application to laboratory pfasmas
J. R. Lemen
Mullard Space Science Laboratory, Holmbury St. Mary, Dorking, England
K. J. H. Phillips
Space and Astrophysics Division, Rutherford Appleton Laboratory, Chilton, Didcot, Oxon, England
G. A. Doschek
E. o. Hulburt Center for Space Research, Naval Research Laboratory, Washington, DC 20375
R. D. Cowan
Los Alamos National Laboratory, p.o. Box 1663, Los Alamos, New Mexico 87545
1960
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DIELECTRONIC
sible from excited levels as wen as the ground level, the die-
lectronic line intensities have a dependence on electron den-
sity. Generally, for any particular line, there will also be a
smaller contribution due to inner-shell excitation by electron
CAPTURE
i -------- ~
AUTOIONIZA TION
If j(1s2s22 p n+2)
collisions. Again, the incident ion may have more than one m' -------- Ejm
level in its ground configuration, each with substantial popu-
lation. Lines of Fe xx, then, as well as being dielectronically
excited from Fe+ 20 ions, may also result from the collisional
excitation ofFe+ 19 in any of its ground configuration levels
(1 s~s~pn) ====-T-LEa----J'~:-.t~~~
{ m IONIZATION
ENERGY
X+Z+l+e
(ls22s 2 2p 3 4S3/2 , 2P 1/2 , 2P3/2 , 2D3/2 , 2D5/2 ). Lines of an ion
with comparable die1ectronic and collisional contributions
to their excitation have intensities that are temperature de-
pendent in the following manner: The dielectronic excitation +---+--k'
depends on the number density of ions in the stage immedi-
ately above (e.g., in the case of Fe xx lines, of Fe + 20 ions),
whereas collisional excitation depends on the number den-
sity of the ion itself (Fe + 19 ions).
In papers I and II, we presented synthetic Fe XIX-XXIII
spectra, including dielectronic and collisional excitation
processes and using Voigt profiles for the line shapes describ- FIG. I. Energy-level diagram illustrating the excitation of a Is-2p emission
ing the thermal Doppler and instrumental broadening. At- line in a general ion X + '. The doubly excited level j may be formed by
tention was drawn to the strong electron density dependence dielectronic recombination of ion X .. , + 1 in one of its ground configuration
levels (e.g., m) or by collisional excitation of ion X +, in one of its ground
of Fe xx lines in particular. This is also true for Fe XXI lines, configuration levels (e.g., k).
but two lithiumlike iron (Fe XXIV) satellites with transi-
tions ls22p-ls2s2occur at these wavelengths; Fe XXI is thus a hot enough to excite them.
less useful density diagnostic unless the temperature is too
When radial profiles of electron temperature and den-
small for excitation of the Fe XXIV lines. The relative contri-
sity in tokamak or similar plasmas are available from Thom-
bution made by collisional excitation to individual lines is
son-scattered laser radiation, line spectra can be computed
approximately constant with temperature in the small tem- from the same ions that a spectrometer would record view-
perature range over which two adjacent ions (e.g., Fe + 19
ing the plasma in a given direction: for such a calculation, ion
and Fe+ 20 in the case of Fe xx lines) are formed (coronal
radial distributions must be assumed or taken from some
ionization equilibrium being assumed in these calculations) .
model. A computer program was written to do this for arbi-
Comparison of the calculated results (paper I) with solar-
trary lines of sight through a model tokamak plasma, taking
flare spectra showed excellent agreement with calculated Fe published calculations of radial iron ion densities II for
xx and XXI spectra in the low-density limit, indicating densi- steady-state coronal diffusive equilibria. This is also done for
ties Jess than 10 12 cm- 3 , which is supported by other mea-
a time-dependent case in which iron is injected into this same
surements. The calculated density dependence was con-
plasma. The calculated spectral show small but measurable
firmed by a spectrum of this region from the PLT tokamak, 8
differences, offering a "synthetic" means of spectroscopical-
showing Fe xx lines with the same appearance as the synthe-
ly determining the diffusion transport coefficients of similar
sized spectrum for an electron density of2 X 10 14 cm- 3 , near
plasmas. Generally, transport coefficients are determined by
that measured by Thomson-scattered laser radiation.
"analytic" means, in which radial ion densities are deduced
In this paper, further calculations are presented for ti- from the radial dependence of total ion radiances. 9. 1 I It is
tanium, chromium, and nickel as well as iron, these elements
shown that this technique. applied to the line spectra consid-
being frequently observed in laboratory plasmas-in the
ered here, must allow for the density effects we calculate for
case of tokamaks, either because of wall erosion or deliberate
a proper determination of radial ion densities.
injection. We shan consider the carbon, nitrogen, and oxy-
gen isoelectronic sequences, these stages showing the great- II. LINE EXCITATION
est density dependence in their x-ray spectra. We find that
the density dependence observed in Fe XX, for example, also A. Theory
occurs in N I-like titanium, chromium, and nickel at a wide The theory presented here follows papers I and II and
variety of electron densities: roughly 10)] to 10 15 cm -3. In the papers of Merts, Cowan, and Magee l2 and Doschek,
principle, then, a spectroscopic density diagnostic technique Feldman, and Cowan. 13 We shall consider ls-2p linesofC 1-,
is available for laboratory plasmas ranging from tokamaks N 1-, and 0 I-like ions; the transitions are 1s22s22p"-
(Ne_10 13_10 14 cm- 3 : e.g., de Michelis and Mattioli9 ) to ls2s22p" + I with n = 2, 3, and 4, respectively. This is illus-
theta pinches (Ne_10 16 cm- 3 : e.g., Lang 1o ), which could trated by the energy-level diagram of Fig. 1, showing the
have application if laser-scattering techniques were unavail- excitation of such a line by dielectronic and collisional exci-
able. There is a similar density dependence in the C I-like tation in a general ion X + Excitation by collisional ioniza-
Z •
lines but, as with Fe XXI, this is confused by the presence of tion of a Is electron is unimportant (see paper I and Merts;
the 1s22p-ls2s2 lines of the lithiurnlike stage if the plasma is Cowan, and Magee 12). The excitation of an autoionizing lev-
1961 J. Appl. Phys., Vol. 60. No.6. 15 September 1986 Lemen etal. 1961
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elj in ion X + Z occurs by the dielectronic recombination of combination and of ion X + for collisional excitation.
Z
ion X + Z + I in one of the fine-structure levels of its ground Transitions having nonparticipating electrons with
configuration; the energy Ejm is the kinetic energy of the n> 2 (e.g., 1?'l?-2pnl-ls'l?-2p 2nl, n > 2, in the case of C 1-
electron being captured. With inner-shell collisional excita- like ion lines) were considered unimportant, as was found
tion, levelj is excited by electron collisions from one of the for Fe XX-XXIII lines by Doschek, Feldman, and Cowan. 13
fine-structure levels (say k ") of the ground configuration of We shall not consider any collisional effects on autoionizing
ion X+ z. In each case, the ion in level j may radiatively states, such as collisional redistribution of I states (see paper
deexcite to any level k ' or autoionize to form the ion X + + I Z II) which are important for laser-produced plasmas: thus
in any level m' (below j) plus a free electron. Radiative deex- our results are applicable for electron densities of up to a few
citation to a level k in the ground configuration of X + re- Z times 10 16 cm- 3 •
sults in emission in one of the lines considered here. The The equations for line emission by dielectronic recom-
density dependence of the line emission arises through the bination and collisional excitation are given in paper I, so we
density-dependent populations in the fine-structure levels of shall only briefly outline them here. For dielectronic excita-
the ground configuration of ion X + + I for dielectronic re-
Z tion, the emission rate of photons in aline j-+k is given by
I
(1)
where
" N z + l.rn A 1m (3)
D=~ .
(2) J m Nz+ Igm
A convenient way of expressing relative line intensities is the
product gjB JkDj' which contains only atomic factors. Val-
ues of this product are tabulated below for all transitions
and the summation over m includes the levels in the ground
considered, as was done in paper I for the most intense lines.
configuration of the ion X + z + I. In Eq. (2), AQ and A rare
For excitation of this same line (j-+k) by electron colli-
autoionizing and radiative transition probabilities between
sions, we consider the target ion X + z to be in level k " , one of
the denoted levels. In Eq. (1), gj is the statistical weight of
the ground configuration levels. As in paper I, we use van
the autoionizing levelj, Ejm the excitation energy of the level
Regemorter's approximation for the collisional rate coeffi-
j relative to the level in the X + z + I ion, and Te the electron
cient for excitation from level k " to j, which is taken to be
temperature; N z + I.m is the number density (cm - 3) of ions
proportional to the oscillator strength ik"j and a tempera-
X + z + I in level m and N z + I the number density (cm - 3) of
ture-averaged Gaunt factor P. More precise calculations of
all ions X + z + I.
the excitation rates are not available for the transitions and
The density dependence of the hne j-+k excited by this ions involved. Use of van Regemorter's approximation is,
process, which occurs because of the density-dependent po- however, justifiable in view of the generally smaller impor-
pulation Nz+ '.m/Nz+ I in Eq. (1), may be expressed by the tance of collisional excitation. The emission rate ofj-+k pho-
factor tons in this case is then given by
H·=I NNzEik"j .
k "
Chaps. 8 and 16, and paper n.) A non relativistic version of
(5) the RCN/RCG programs was used, the relativistic corrections
J k" jk "
primarily affecting the wavelengths rather than the rates
The relative strengths oflines excited by electron collisions is (and thus line intensities). These, together with Breit inter-
conveniently expressed by HjB Jk (units of eV- I ), contain- action and QED corrections, affect the wavelengths to a
ing only atomic factors. comparable degree to the ls-2p iron lines, being in the same
wavelength region. For Fe XXIII-XXV Hnes, we found in pa-
B. Procedure per II that the nonrelativistic RCN/RCG wavelengths were 2-
The RCN/RCG computer programs were used for wave- 3 rnA smaller than those calculated from a multiconfigura-
lengths, excitation energies, and autoionization and radia- tion Dirac-Fock (MCDF) code 14 in which Breit interaction
tive rates needed in Eqs. (1 )-( 5). Single-electron radial and QED corrections are included. A similar difference ex-
1962 J. Appl. Phys., Vol. 60, No.6, 15 September 1966 Lemenetal. 1962
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TABLE 1. Values of wavelength and gjBI.D) (5-') for principal" lines at the stated N, (cm -3).
Ti XVIII c
1963 J. Appl. Phys.• Vol. 60, No.6, 15 September 1986 Lemen etal. 1963
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ists between the Cowan wavelengths of the lower ions die1ectronic factors gjB JkDj and wavelengths derived from
Fe XIX-XXII and those calculated by Grineva, Safronova, the MCDF code of Rata and Grant. 14.16 The values of B lk
and Urnov l5 using a relativistic Z-expansion technique. The were taken from the RCN/RCG programs for Ti, Cr, and Ni.
MCDF wavelengths have greater absolute accuracy, so we
present RCN/RCG wavelengths with a constant shift for each
III. CALCULATED SPECTRA
element determined from comparison with MCDF wave-
lengths l6 for the two strongest Is-2p lines of Be-like Ti, Cr, A. Spectra from an Isothermal, single-density plasma
Fe, and Ni. Spectra for the C 1-, N 1- and 0 I-like ions of each de-
The density-dependent populations of the ground con- ment were synthesized using a single value for the electron
figuration levels of B 1-, C 1-, N 1-, and 0 I-like ions of the and the ion temperature and for electron density. We display
elements considered here are needed in the calculation of Dj them to illustrate their variation with electron density.
[Eq. (3)] and Hj [Eq. (6)]. For chromium and nickel, we Fractional ion abundances at the chosen electron tem-
used the values of Feldman et al. 17 and for titanium those of peratures were calculated from published coronal equilibri-
Bhatia et al. 18 For the case of iron, we used the calculations um values with modified ionization rates. The radiative and
discussed in paper I. Excitation by both protons and elec- dielectronic recombination rate coefficients were obtained
trons is included in these calculations. As well as being den- from the fitting parameters tabulated by Shull and van
sity dependent, the level populations are slightly tempera- Steenberg,19.20 correcting for some erroneous values. They
ture dependent, e.g., being less than 10% over a wide range also list parameters for ionization rate coefficients, but we
for C I-like iron (see paper J). This dependence was ignored chose to use values given by Burgess and Chidichimo,21 their
here, the temperature being taken as that of maximum con- procedure making a more elaborate allowance for coupling
centration of the relevant ion in coronal equilibrium. The between final states like those considered here. The energy-
dielectronic recombination and collisional excitation pro- level data necessary in this calculation were taken from the
cesses considered here do not themselves alter the popula- papers of Corliss and Sugar22- 24 and Sugar and Corliss,25 as
tions of the ground configuration levels. were the ionization energies.
Table I gives wavelengths and values of the dielectronic Account has not been taken of high-density effects in the
excitation factors gjB lkDj for all transitions calculated by calculation of ion fractions, in particular the decrease of the
the RCN/RCG program in the ls22s22p· -ls2s2p· + I (n = 1- dielectronic recombination coefficient at high electron den-
4) arrays of 0 1-, N 1-, C 1-, and B I-like Ti and Cr. Dielec- sities. No specific calculations exist for the ions of interest
tronic excitation factors are given for Ne = 1011, 1013, and here. However, Summers 26.27 has calculated density-depen-
1015 cm- 3 . Table n gives corresponding values for Fe and dent ionization equilibria for elements up to sulfur and for
Ni. The tabulated wavelengths are calculated values in- electron densities up to 10 16 cm -3, much more than typical
creased by 0.0029 A for Ti, 0.0026 A for Cr, 0.0023 A for Fe, tokamak values. In the case of the N-like ion, for instance,
and 0.0021 A for Ni, determined as mentioned above by the temperature dependence of the low-density fractional
comparison with MCDF wavelengths. Table HI gives wave- ion abundance is very little different from that of the frac-
lengths and collisional excitation factors HjB Jk for aU transi- tional abundance at 10 16 cm -3 for the elements Summers
tions in which the collisional excitation transition corre- considers. There is no obvious trend of this difference with
sponds to an optically allowed transition in the same ions of atomic number, but it is probably safe to conclude that it
Ti and Cr; Table IV gives this information for Fe and Ni does not increase appreciably for the elements of interest to
ions. Values are given for the same densities as in Tables I us.
and II. With the wavelengths and intensity factors for each line
The calculated spectra presented below include the one- (Tables I-IV) and ion fractions, spectra could now be syn-
photon, two-electron satellites of the lithiumlike stage. The thesized. This was done by giving each line a wavelength
two lines, with transition Ir2p-ls~, are labeled 0 and p by profile such as is obtained with a typical crystal spectrom-
Bely-Dubau et al. 2 and in previous papers by these authors. eter. Observed line shapes are a convolution of profiles de-
They are excited both dielectronically and collisionany. The scribing instrumental broadening and those intrinsic to the
dielectronic intensity may be expressed by the factor emission source such as thermal Doppler broadening. We
gJBJkDj . [In Bely-Dubau et al.'s notations, this equals took as an example of an instrumental profile that for the
F2 (s).] Effective collisional rate coefficients for the two bent-crystal spectrometer on the Solar Maximum Mission
Fe XXIV lines were taken from Bely-Dubau et ai., but ex- spacecraft,28 which employs a germanium crystal, observa-
pressed in tabular form by the HjB lk factor used for the tions of which were compared with theory in papers I and H.
lower ions here. Thus, the rate coefficients were expressed in This function is made up of a Gaussian to describe electron-
terms ofvan Regemorter's approximation for collisional ex- ics noise broadening [full width at half maximum (FWHM)
citation. The effective rate coefficients have the form of 4 X 10- 4 A, independent of wavelength] and a Lorentzian
/3 exp( - W /kT. )/Te 112, wherep is almost constant. Val- profile for the crystal rocking curve (FWHM of7 X 10- 5 A
ues of P for Fe XXIV were derived from Bely-Dubau et al.'s at 1.85 A, taken to scale with wavelength). The spectral
excitation rate coefficient. For other ions, values of Pmay be resolving power then corresponds to A. / aA. - 4000. The final
derived from a Z scaling of the rate coefficients. For a parti- line shape is a Voigt profile, being a convolution of the in-
cular value of "reduced temperature," T./Z 2, the rate coef- strumental profile and the thermal Doppler broadening, de-
ficients scale as Z -3. Table V gives these together with the fined by the ion temperature. Drayson's29 routine was used
1965 J. Appf. Phys., Vol. 60, No.6, 15 September 1986 Lemen eta!. 1965
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TABLE Ill. Values of wavelength and HjBj. (eV-I) for principal" lines at the stated N. (em -3).
b
TRANSITION A (A) 1.00(11) 1.00(13) 1.00(15) A(A) 1.00(11) 1.00(13) 1.00(15)
2 2
IS 2 2S 2p - lS2S 2p 2 Array
C
Ti XVIn Cr Xxd
2 2
2~3/2 : 2~3/2
2.6691
2.6{,;80
1.39(-6)
9.73(-6)
6.81(-7)
5.33(-6)
5.46(-7)
4.49(-6)
2.2266
2.2261
2.41(-6)
8.36(-6)
1.65(-6)
5.94(-6)
9.81(-7)
3.82(-6)
2 p 3/2 _ 201/ 2 2.6678 4.22(-7) 6.75(-6) 7.90(-6) 2.2263 8.87(-8) 4.19(-6) 7.76(-6)
2 p 3/2 _ 205/ 2 2.6652
_ 2 p 3/2 2.64(-5) 1. 30 (-5) 1.04(-5) 2.2239 2.84 (-5) 1.95(-5) 1.16(-5)
2p1/2 2.6642 3.69(-5) 2.2234 3.41(-5) 2.43(-5)
_ 2p1/2 2.02(-5) 1.70(-5) 1.56(-5)
2p1/2 2.6637 2.2215 2.28(-6) 1. 64 (-5)
2 p 3/2 _ 2 p 3/2 4.80(-6) 2.88(-5) 3.31(-5) 2.87(-5)
_ 2 3/2 2.6598 1. 52 (-7) 9.11(-7) 1.05(-6) 2.2189 5.03(-8) 3.61(-7) 6.32(-7)
2p1/2 S 2.6588 6.39(-7) 2.2192 2.91(-7) 2.40(-6)
3/2 1/2 3.51(-6) 4.03 (-6) 4.25(-6)
1966
[This article isJ.copyrighted
Appl. Phys.,as
Vol. 60, No. in
indicated 6,15
theSeptember 1986
article. Reuse Lemen etal.
of AIP content is subject to the terms at: http://scitation.aip.org/termsconditions. 1966
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TABLE IV. Values of wavelength and HjD}. (eV--') for principal" lines at the stated N, (cm- J ).
Fe XIX
c
Ni XXl d
1 3
10 2 - P
1 2
1.9225 7.85(-7) 7.39(-7) 5.11(-7) 1.6470 1.06(-6) 9.92(-7) 5.80(-7)
5 - 3P1 1.9214 3.94(-8) 1.99(-7) 1.17(-6) 1.6453 3.37 (-8) 9.43(-8) 9.02(-7)
3 0
P - 3P2 1.9199 2.34(-6) 2.20(-6) 1.52(-6) 1.6449 2.65(-6) 2.48(-6) 1.45(-6)
3 l
3P1 - 3P l 1.9180 1.26(-6) 1.19(-6) 8.12(-7) 1.6432 9.55(-7) 9.41(-7) 1. 09 (-6)
P - 3 P1 1.9175 2.05(-6) 1.93(-6) 1.32(-6) 1.6422 1.67(-6) 1.65(-6) 1.91(-6)
3 O
P - 3P2 1.9167 6.24(-6) 5.87(-6) 4.06(-6) 1.6417 6.92(-6) 6.47(-6) 3.78(-6)
3 2
P
l 0l - l PO 1.9157 4.17(-9) 3.28(-7) 1.10(-6) 1.6407 2.17 (-8) 3.77(-7) 3.73(-7)
3 2 - 3P 1 1.9154 1.70(-7) 8.60(-7) 5.06(-6) 1.6406 1.41(-7) 3.93(-7) 3.76(-6)
P2 - P 1.9148 3.36(-6) 3.15(-6) 2.16(-6) 1.6400 2.89(-6) 2.85(-6) 3.31(-6)
l
lS 2 2S 2 2p 3 _ lS2s 2 2p 4 Array
Fe XX
C
Ni XXll d
2 4
2~5/2 : 4:5/2
1.9137
1.9124
8.22(-7)
7.40(-7)
6.91(-7)
6.21(-7)
2.99(-7)
2.69(-7)
1. 6399
1.6386
1.02(-6)
1.11(-6)
9.37(-7)
1. 02 (-6)
4.40(-7)
4.79(-7)
20 3 / 2 _ 4 p 5/2
1.9112 5.74(-7) 4.80(-7) 2.02(-7) 1. 6375 1.02(-6) 9.37(-7) 4.20(-7)
2 p 5/2 _ 203/ 2
_ 2 p 5/2 1.9110 3.32(-8) 4.66(-7) 1. 37 (-6) 1.6375 2.38(-8) 2.88(-7) 1.26(-6)
2 p 3/2
_ 4 p 3/2 1.9093 4.35(-8) 3.79(-7) 1.12(-6) 1.6362 3.27(-8) 2.18 (-7) 9.93(-7)
4 S 3/2
_ 2 p 5/2 1.9079 7.90(-6) 6.63(-6) 2.88(-6) 1.6348 7.16(-6) 6.56(-6) 3.08 (-6)
2 p 3/2
_ 2p1/2 1.9072 6.99(-9) 2.93(-7) 1. 73 (-6) 1. 6341 6.60(-9) 1.00(-7) 1.49(-6)
2p1/2 1.9070 4.87(-8) 4.25(-7) 1. 26 (-6) 1. 6338 3.81(-8) 2.54(-7) 1.16(-6)
20 1 / 2 _ 203/ 2
1. 9057 2.53(-7) 1.36(-6) 4.56(-6) 1.6329 2.30(-7) 6.61(-7) 4.01(-6)
4 S 3/2 _ 4 p 3/2
1.9054 7.84(-6) 6.55(-6) 2.75(-6) 1.6324 8.66(-6) 7.92(-6) 3.55(-6)
20 3 / 2 _ 203/ 2
1.9054 7.09(-8) 9.96(-7) 2.93(-6) 1.6326 4.96(-8) 6.01(-7) 2.62 (-6)
45 5 / 2 _ 4 p 5/2
1.9046 3.34(-6) 2.77(-6) 1.15(-6) 1.6317 3.34(-6) 3.03 (-6) 1.33(-6)
2 p 3/2 _ 25 1/ 2 1.9039 5.21(-9) 6.97(-8) 1.62(-6) 1. 6312 1.94(-9) 1.56(-8) 1.21(-6)
20 3 / 2 - 2p1/2 1.9037 1.50(-7) 1.31(-6) 3.89(-6) 1.6312 1.13 (-7) 7.55(-7) 3.44(-6)
20 5 / 2 _ 2 p 3/2
1.9026 6.68(-9) 2.80(-7) 1.66(-6) 1.6303 6.40(-9) 9.71(-8) 1.45(-6)
3/2 1/2
Fe XXI C Ni XXIIl d
10 3
- 30 3 1.9014 5.74(-8) 8.55(-7) 1. 04 (-6) 1.6299 3.26(-8) 8.22(-7) 1.22(-6)
3 2 1. 6281 7.85(-6) 4.31(-6) 6.97(-7)
P - 30 1 1.8990 6.22(-6) 2.52(-6) 7.37(-7)
10 2 1.6236 8.30(-10) 1.78(-7) 4.48(-6)
3 2 - 3 P2 [e]1.8943 6.56(-9) 1.22(-6) 1.08(-5)
P - 30 3 1.8970 1.46(-7) 2.17(-6) 2.65(-6) 1.6259 6.41(-8) 1.61(-6) 2.40(-6)
3 2
P - lD2 1.8968 8.84(-8) 2.68(-6) 3.10(-6) 1. 6259 3.49(-8) 1. 70 (-6) 3.61(-6)
1 1 1.8963 1.6251 5.34(-10) 5.71(-8) 1.75(-6)
5 - 3P 1 1. 82 (-9) 2.01(-7) 2.20(-6)
3 0 1. 6247 8.04(-7) 1. 82 (-6)
P - 35 1 1.8954 1.52(-6) 3.03(-6) 2.92(-6) 2.66 (-6)
3 2 1.8948
1 PO - 101
2.98(-5) 1.21(-5) 3.53(-6) 1.6241 3.10(-5) 1.70(-5) 2.75(-6)
0 - 30 2 1.8980 1.10(-7) 1. 63 (-6) 1.91(-6) 1.6272 5.53(-8) 1. 39 (-6) 1.89(-6)
3 2 1.8939 3.77(-6) 1. 6233 2.20(-6)
3Pl - 35 1 7.53(-6) 7.25(-6) 4.99(-6) 7.28(-6)
P - 1P1 1.8926 2.05(-7) 2.87(-6) 3.08(-6) 1. 6223 9.04(-8) 2.24(-6) 2.81(-6)
1 2 1.8913 2.72(-9) 1.6212 8.48(-10) 2.78(-6)
0 - 1P1 3.00(-7) 3.28(-6) 9.07(-8)
3 2 1.8937 6.20(-6)
P2 - °2 3.49(-7) 5.18(-6) 6.09(-6) 1. 6231 1.81(-7) 4.57(-6)
2 2 2 2
1S 2S 2p - lS2s 2p Array
Fe xxn c Ni XXIVd
2 2
1.8874 3.41(-6) 2.97(-6) 1.48(-6) 1.6188 3.97(-6) 3.78(-6) 1.86(-6)
2:3/2 : 2g3/2 1.8873 7.08(-6) 6.21(-6) 3.32(-6) 1.6188 6.14 (-6) 5.87(-6)
2 p 3/2 _ 201./2 3.03(-6)
1.8855 2.12(-8) 1.65(-6) 7.08(-6) 1.6166 5.94(-9) 5.48 (-7) 6.22(-6)
2 p 3/2 _ 205 / 2 1.8831 2.83(-5) 2.46(-5) 1.23 (-5) 1.6147 2.72(-5) 2.60(-5)
_ 2 p 3/2 1.27(-5)
2p1/2 1.8830 3.03(-5) 2.66(-5) 1.42(-5) 1. 6148 2.64(-5)
2p1/2 _ 2.52(-5) 1.30(-5)
2p1/2 1.8824 1.22(-6) 6.57(-6) 2.44(-5) 1.6140 7.57(-7)
2 p 3/2 _ 2 3/2 2.48(-6) 2.05(-5)
S 1.8797 1.21(-7) 1.07(-6) 4.21(-6) 1. 6120 5.43(-8) 3.90(-7) 3.91(-6)
3/2 1/2
1967 J. Appl. Phys., Vol. 60, No.6, 15 September 1986 Lemen etal. 1967
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TABLE V. Li-Iike lines of Ti, Cr, Fe, and Ni. Note: Powers of 10 are indi- for computing the Voigt profile.
cated in parentheses.
Figures 2 and 3 depict the synthetic spectra of C 1-, N 1-,
and 0 I-like ions ofTi, Cr, Fe, and Ni for the three densities
Ion T ransi tion· Ne = 1011, 1.0 13 , and 10 15 cm- 3 . Intensities ofIines excited
both dielectronically and coHisionaUy are shown, together
Tixx 1.r2p 2Pl/2-lsY 2S I /2d 2.6737 6.64(12) 5.44( - 10) with the coHisionaI part alone. The ion temperature is as-
Tixx 2P3/ T"" 2S1/2' 2.6779 8.75( 12) 5.39( - 10)
CrxxlI 1.r2p 2P 112-lsY 2S112d 2.2313 9.35(12) 5.29( - 10) sumed equal to the electron temperature. The spectra were
CrxxlJ 'P"2- 2S112 ' 2.2355 1.10(13 ) 5.24( - 10) calculated for temperatures corresponding to the maximum
Fe XXIV 1.r2p 2P1/2-lsY 2S Il2 d 1.8932 1.69( 13) 2.08( - 10) fractional abundance of the C I-like ionization stage. As a
Fe XXIV 2P3I2- 2S
112' 1.8978 1.67( 13) 2.06( - 10)
1.r2p 2P112-lsY 2S 112 d
result, the strongest line intensities of the C I-like ion are
Nixxvi 1.6205 1.68(13) 4.65( - 10)
Nixxvi 2P"2- 2S
112
' 1.6249 1.52(13 ) 4.61( - 10) comparable to those of the N I-like ions_ These temperatures
are too small for appreciabJ.e excitation of the one-photon
• Principal LS level contributors given. two-electron transition ls22p-ls2s2 in the lithiumlike stage
b Wavelengths from Hata and Grant (see Ref. 16). (lines 0 and p), whose wavelengths for all four elements are
"Collisional excitation rate coefficient (em) S-I): = /3exp( - EjklkT.)1
T!12 (/3-oon5t; see Sec. II B). The excitation energies, Ejk (eV), forthe
near to those of the C I-like ion lines.
IsY 2S 112 levels are 4683 (Ti), 5609 (Cr), 6604 (Fe), 7719 (Nil. For the 1~2?2p2_1s2s22p3 lines of the C I-like ion, the
d Satellite line p in Gabriel's 1972 notation. two lines IDI-ID2 (A = 2.6831 A in the case ofTi XVII) and
e Satellite line o.
a) TITANIUM b) CHROMIUM
11
Ne = 10 cm- 3 Ne = 10"cm- 3
T.= 5.1 x 106 K To = 7.3 x 106K
TiXVIl
TiXVI
TiXV
2260 2.270
FIG. 2. Calculated (a) Ti XV-XVII and (b) Cr XVII-XIX line spectra for electron densities 10", 10", and 10 15 cm- l and forthe indicated electron tempera-
tures. The ion temperature is set equal to the electron temperature. The calculated line wavelengths include a small shift (see Sec. II B). The solid curves
represent intensities of lines both dielectronically and oollisionally excited, while the dashed curves are for collisional excitation alone.
1968
[This J. Appl. Phys.,
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in the September 1986
Reuse Lemen etal.
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a) IRON b) NICKEL
Ne = 10 cm- 3
11
Ne == 1011 cm- 3
Te == 9.5 x 106K Te == 11.7 x 106 K
NiXXII
o o
WAVELENGTH (A) WAVELENGTH (A)
FIG. 3. Calculated (a) Fe XIX-XXI and (b) Ni XXI-xxlIIline spectra. See Fig. 2 for details.
3p2 _3D 3(2.6871 A) are stronger relative to nearby lines for crease in the 2P3/2 leve:! of the B I-like ion.
increasing density, as can be seen from Table 1. For these two Corresponding changes occur in the N I-like ions. in
lines, as with most, dielectronic excitation predominates which the 2Ds/2-2Ds/21ine (at 2.7009 A in Ti XVI) increases
over collisional excitation. Dielectronic excitation of C I-like strongly with density. For N I-like ion lines. dielectronic ex-
ion lines proceeds from the ground configuration ( 1~2s22p) citation proceeds from the ground configuration ( ls2~2p2)
ofthe B I-like ion, which has levels 2P 1/ 2 (ground) and 2P3/2 of the C I-like ion. which has levels (in increasing order of
(excited). For the two lines mentioned, the dielectronic cap- excitation energy) 3PO' 3P1• 3P2 • ID2 • and ISO' The dielec-
turerate is much higher when the B I-like ion is in the excited tronic capture rate of the upper level of the 2DS/2-2DS/2line is
level 2P3/2' which is populated at larger densities (~10 12 very small from the C I-lik.e ground level 3po• and is only
cm- J for Ti). Referring to Eq. (2), this is equivalent to appreciable for the ID2 level. the population of which is only
saying that the value of A 1m' is much higher for the second significant at higher densities (N. > 1013 cm- 3 for Ti).
term (m' = 2) of the two-term summation, corresponding Considerable changes in the spectra of each ion with
to the B I-like 2P312 level, than the first (m' = 1). corre- electron density are indicated in Figs. 2 and 3. Such spectra
sponding to the ground level 2PI / 2 • Thus. these lines are would be useful for application to high-temperature plasmas
more intense at higher densities through the population in- for which there are no other density diagnostics.
1969 J. Appl. Phys .• Vol. 60. No.6. 15 September 1986 Lemenetal. 1969
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Cross section FIG. 4. Geometry of a spectrometer (S)
of Plasma Torus viewing plasma torus for deriving Eqs. (8)
and (9).
~-------L--------~------
B. Spectra from an Idealized tokamak corresponding quantity for the collisional excitation of ion
The theoretical spectra of Figs. 2 and 3 would result X + Z • Both are specifiable functions of r.
from the idealized case of a very hot plasma with constant The r dependence of quantities in Eq. (7) may be ex-
density and temperature. In the case of a tokamak, the plas- pressed in terms of the distance I, measured along the
ma is in the form of a torus with some spatial distribution of spectrometerline of sight (see Fig. 4):
temperature and density, the line emission arising from ei- r(l) = [/2 - 2(R + L)l cos (J + (R + L)2] 1/2, (8)
ther a background impurity element, i.e., one that is a con-
in which (J is the angle between the spectrometer line of sight
stituent of the tokamak device, or one that is injected by
and the line through the torus center, R the radius of the
some technique. We now discuss line emission that would be
plasma, and L the spectrometer distance from the nearest
observed by a spectrometer from a model tokamak plasma.
edge of the plasma. Taking A V = AA1, where A is the
We shall assume symmetry in the poloidal and toroidal di-
spectrometer aperture area, considered small compared
rections of the tokamak, this being justified by the fact that
with the torus dimension, the flux of the line j-k along a line
particle motion in these directions is along field lines and
of sight is given by
consequently fast compared with the radial, cross-field di-
rection. Spectra are synthesized which the spectrometer
would observe in the geometry indicated in Fig. 4: the plas-
F(j_k) = 2 J:"'" Ne(r(l»)[ Nz+ dr(l)k6~+ dr(l»)
ma is viewed along a path across the torus, not necessarily + Nz(r(/)}t/>;(r(/»JA dl photons S-I, (9)
through its center. The plasma torus is assumed to have a
circular cross section, and an electron temperature and den- where Lo is the value of L where the line of sight is closest to
sity to be known functions of radius r, which, in the real case, the torus center and Lmax is the maximum value of L, given
may be experimentally determined by Thomson-scattered by Lo = (R + L)cos (J and Lmax = (R + L)cos 0
laser radiation. + [R 2 _ (R + L)2 sin 2(J] '/2. Knowing radial distribu-
The emission of one of the lines )-k considered here, tions of the ion densities N z and of Te and N e , and with the
emitted as described in Sec. n, from a volume element AVin atomic data of Tables I-IV, one can calculate the complete
the plasma is spectrum of C 1-, N 1-, and 0 I-like Ti, Cr, Fe, or Ni. In the
calculation below, we take the case L = R and (J = 0 and 15°.
AF(j-k) = [Rd(j_k) +Rx(j_k)]AV photons s-', For the latter case, the spectrometer line of sight passes to
(6) within O.S2R of the torus center.
where Rd (j_k) and R X (j_k) are given in Eqs. (1) and We numerically evaluated the integral in Eq. (9) to give
(4). In Eqs. (1) and (4), the density (N. ) of, e.g., ion X +. iron line spectra from three one-dimensional model calcula-
tions discussed by Hulse. 11 These calculations, performed by
in general depends on position in the torus, i.e., with poloidaI
the so-call.ed MIST computer code, use radial profiles of T.
and toroidal symmetry, on r. With Te and Ne functions of r,
and N e , ioni.zation and recombination rates (not quite the
Eq. (6) may be rewritten as
same as those used in Sec. HI A), and adjustable radial
AF(j-k) = N.(r)AV [Nz+ 1 (r)t/J:+ 1 (r) transport coefficients to derive radial distributions of impu-
+ N z (r)t/>;(r)] photons s-', (7) rity ion densities. In calculating the spectra, we used the
model radial profiles of T. and N. from one of Hulse's fig-
t/>: + 1 containing the temperature-dependent and atomic fac- ures which apply to all three of the calculations. They are
tors for the dielectronic excitation of ion X + z + I , 'f'z
,/,.x the representative of large tokamaks (peak T. = 2 keY,
~
introduced with a zero recycling coefficient, so that the im-
purity content decreases with time. Hulse's figures give ion
density radial distributions at three times subsequent to the
injection of the impurity at the outer edge of the plasma; in
his model some of the ions diffuse inwards towards the cen-
0.5 ter of the torus, where they become highly ionized, some to
the stages of interest here.
In Hulse's diffusive calculations (models II and III).
the number density of ions Fe + z were solved from
dNz 1 d
- = ---d (rr z ) +Iz_INz _ 1 - (lz +R.)Nz
dt r r
1971 J. Appl. Phys., Vol. 60, No.6, 15 September 1986 Lemen etal. 1971
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TABLE VI. The effect of density on total flux. Relative fluxes in the indicat- 0.003 F"""'1r--...--r---,---r--....,..--r-~
ed wavelength ranges are given normalized toa density of N, = 10" cm- 3 •
Note: An electron temperature of9.5X 10" K was assumed. t-3.2ms a)
N, (cm- 3 )
0.002
Element A range (A) 10" IOJ) lO'S
1972 J. Appl. Phys., Vol. 60. No.6, 15 September 1986 Lemenetal. 1972
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spectroscopically, but in this case time-resolved spectra We kindly thank Dr. J. Hata and Dr.:L P. Grant for supply-
must be available for comparison with spectra calculated for ing wavelengths of several Be-like ions in advance of publica-
a variety of D z and vz • The MIST or similar code is first ap- tion. The Mullard Space Science Laboratory and Ruther-
plied to find ion densities from which spectra can be calculat- ford Appleton Laboratory are supported by the U.K.
ed. Science and Engineering Research Council.
IV. CONCLUSION
We have presented calculations of Ti XV-XVII,
Cr XVII-XIX, Fe XIX-XXI, and Ni XXI-XXIII x-ray line spec-
tra which are observed from high-temperature tokamak
plasmas. These lines arise from inner-shell ls-2p transitions.
The calculations include aU allowed lines excited by elec-
II. Dubau and S. Volonte. Rep. Prog. Phys. 43.199 (1980).
trons which are dielectronically captured into an n = 2 level. 2F. Bely-Dubau, 1. Dubau, P. Faucher, and A. H. Gabriel. Mon. Not. R.
The relatively less significant contribution by collisional ex- Astron. Soc. 198.239 (1982).
citations has also been included. IF. Bely-Dubau, P. Faucher. L. Steenman-Clark. M. Bitter, S. von Goeler.
Many of the calculated transitions have intensities K. W. Hill. C. Camhy-Val. and J. Dubau, Phys. Rev. A 26.3459 (1982).
"T. F. R. Group. 1. Dubau. and M. Loulergue. J. Phys. B 15.1007 (1981).
which vary with density between 1011 and 10 16 cm- 3 , de- sK. J. H. Phillips, J. R. Lemen. R. D. Cowan. G. A. Doschek. and J. W.
pending on the ion stage. In particular, a line ratio is ob- Leibacher. Astrophys. J. 265. 1120 (1983) (papecI).
served in the N I-like stage for the elements considered here 6J. R. Lemen. K. J. H. Phillips. R. D. Cowan. J. Hata. and I. P. Grant.
which is sensitive to density and could be used as a diagnostic Astron. Astrophys. 135. 313 (1984) (paper II).
'R. D. Cowan. The Theory ofAtomic Structure and Spectra (University of
of plasma density in the absence of other available tech- California Press. Berkeley. 1981).
niques. "K. W. Hill. S. von Goeler. M. Bitter. L. Campbell. R. D. Cowan. B. Fraen-
The potential use of spectroscopic techniques has been kel. A. Greenberger. R. Horton. J. Hovey. W. Roney. N. R. Sauthoff, and
investigated with regard to the study ofion diffusion in toka- W. Stodiek. Phys. Rev. A 19.1770 (1979).
9C. de Michelis and M. Mattioli. Rep. Prog. Phys. 47, 1233 (1984).
mak plasmas. We have integrated the flux which would be 10J. Lang. J. Phys. B 16. 3907 (1983).
observed by a spectrometer which viewed the plasma along "R. A. Hulse. Nucl. Technol.lFusion 3. 259 (1982).
different lines of sight. The spectra have been synthesized 12A. L. Merts. R. D. Cowan, and N. H. Magee. Jr.• Los Alamos Scientific
Laboratory Report No. LA-6220-MS (1976).
including line broadening due to ion motion and assuming a IJG. A. Doschek. U. Feldman. and R. D. Cowan. Astrophys. J. 245.315
typical spectrometer resolution function. We have assumed (1981 ).
representative radial temperature and density profiles and 14J. Hata and I. P. Grant. Mon. Not. R. Astron. Soc. 198, 1081 (1982).
ISyU. I. Grineva, V. I. Safronova, and A. H. Urnov. Lebedev Institute. Mos-
for the radial distribution of ion densities we have compared
cow. Report No. 58 (1975).
three models calculated by Hulse ll : (i) steady-state coronal 16J. Hata and I. P. Grant (private communication).
equilibrium, (ii) steady-state conditions but with a diffusion "u. Feldman. G. A. Doschek. Chung-Chieh Cheng. and A. K. Bhatia.
coefficient which is constant with radius, and (iii) a fully Appl. Phys. 51.190 (1980).
time-dependent model involving an injection of impurity '"A. K. Bhatia. U. Feldman. and G. A. Doschek, J. Appl. Phys. 51. 1464
(1980).
ions. Noticeable differences are observed in the calculated 19J. M. Shull and M. van Steen berg, Astrophys. J. Suppl. Ser. 48. 95 (1982).
spectra for the different models. 20J. M. Shull and M. van Steenberg. Astrophys. J. Suppl. Ser. 49. 351
We suggest that such modeling may yield further inter- (1982).
esting results and we emphasize two points: (a) The com- 21A. Burgess and M. C. Chidichimo. Mon. Not. R. Astron. Soc. 203. 1269
(1983).
parison of synthesized and observed spectra in principle 22C. Corliss and 1. Sugar. J. Phys. Chern. Ref. Data 8. 1 (1979).
should enable the determination of the plasma transport co- nc. Corliss and J. Sugar. J. Phys. Chern. Ref. Data 10. 197 (1981).
efficients, although in practice this may prove somewhat l4C. Corliss and J. Sugar. 1. Phys. Chern. Ref. Data 11, 135 (1982).
25
1. Sugar and C. Corliss. 1. Phys. Chern. Ref. Data 6.317 (1977).
troublesome because of the large number of computer com-
26H. P. Summers. Mon. Not. R. Astron. Soc. 169.663 (1974).
putations necessary. (b) The failure to take into account the 27H. P. Summers. Appleton Laboratory Internal Memo No. 367 (1974).
density dependence of these transitions will lead to inaccura- 28L. W. Acton. 1. L. Culhane. A. H. Gabriel. R. D. Bentley, 1. A. Bowles, J.
cies in determining the ion densities N z (r) for the ions con- G. Firth. M. L. Finch. C. W. Gilbreth, P. Guttridge. R. W. Hayes, E. G.
sidered here. loki. B. B. Jones, B. J. Kent. J. w. Leibacher. R. A. Nobles. T. J. Patrick,
K. J. H. Phillips. C. G. Rapley. P. H. Sheather. 1. C. Shennan. J. P. Stark,
L. A. Springer. R. F. Turner. and C. J. Wolfson, Sol. Phys. 65, 53 (1980).
ACKNOWLEDGMENTS 2"S. R. Drayson. J. Quant. Spectrosc. Radiat. Transfer 16, 6\1 (1976).
ems. Suckewer. A. Cavallo. S. Cohen. C. Daughney, B. Denne. E. Hinnov. 1.
We would like to thank Professor J. L. Culhane (Mul- Hosea, R. Hulse, D. Hwang. G. Schilling. B. Stratton, and R. Wilson.
lard Space Science Laboratory) for his support of this work. Nucl. Fusion 24, 815 (1984).
1973 J. Appl. Phys .• Vol. 60. No.6. 15 September 1966 Lemen etal. 1973
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