Fusion Cross-Sections - 24 - 11 - 2020
Fusion Cross-Sections - 24 - 11 - 2020
Abstract
Fusion reactions in the deuterium cycle (D+D, D+T and D+ 3He) are the main nucleus-nucleus
interactions which occur in tokamaks and stellerators. These reactions are the limiting case between
the Woods-Saxon potential field at nuclear distances and the Coulomb electrostatic potential
(scattering) at longer distances. In this paper several fusion cross-sections, geometric, Gamow-
Sommerfeld and astrophysical S-factors have been reviewed and compared with experimental data
from the last ENDF/B-VIII.0 cross-section library. The XDC-fusion code has been developed to
calculate fusion cross-sections, geometric, Gamow-Sommerfeld and S-factors of the deuterium-cycle
(D-cycle), including resonance parameters (energy and partial width). The software estimates also
fusion reaction heat (Q) and Woods-Saxon/Coulomb proximity potentials. Although relative
differences between fusion cross-sections are lower than 5 %, S-factors present considerable
differences between the energies and partial width (FWHM) of the single-level Breit-Wigner (SLBW)
resonances. The energy at which is placed the maximum fusion cross-section is also different between
cases. In conclusion, fusion reaction models for light nuclei (deuterium, tritium and helium) should be
reviewed in order to apply fusion to energy production in safety conditions.
1. Introduction
Fusion reactions in the deuterium cycle (D+D, D+T and D+ 3He) are the main nucleus-nucleus
interactions which occur in the deuterium cycle (D-cycle) in tokamaks and stellerators fusion reactors
[Smith and Cowley 2010, Donné 2018, Zohm 2019]. Fusion reactions are the limiting case between
the Woods-Saxon potential field at nuclear distances and the Coulomb electrostatic potential
(scattering) at longer distances. In order to overpass the Coulomb electrostatic barrier and achieve
nuclear distances to allow fusion reactions, ionized plasma is confined by a magnetic field inside
tokamaks and stellerators [Knoepfel 1978, Woods 2006]
Fusion reactions are characterized by their fusion cross-sections and described by three energy
dependent functions: geometric, Gamow-Sommerfeld and astrophysical S-factor. These factors retain
the physical characteristics of fusion reaction: a Coulomb electrostatic potential barrier penetration,
in a form of an exponential attenuation, G(E), and a strong force interaction after tunneling effect in
the nuclear potential well (Woods-Saxon), at the boundary conditions, in a form of an astrophysical
S(E) factor or resonance function [Miley et al 1974, Li 2002, Chen 2016].
f ( E ) GS
where ϕ is the geometric factor, a term inversely proportional with incident particle energy, S is a
strong-energy correlated parameter S-factor, called also astrophysical or S-factor, which depends on
the boundary conditions between nuclear well and Coulomb electrostatic field and G(E), a tunneling
or penetration factor, called Gamow-Sommerfeld factor. In particular, the astrophysical S-factor is a
resonance function, based on the classical formula of Breit-Wigner of single-level resonances [Breit
and Wigner 1936].
Fusion cross-section of light nuclei were firstly estimated by the Naval Research Laboratory, who
published a 5 parameter formula for D+D, D+T and D+ 3He light nuclei fusion reactions, also known as
Duane 5-parameter formula, based on accelerator beam-target experiments [NRL 2019].
In the last decades, fusion cross-sections have been modeled with a complex phase-shift of the
incident wavefunction at the boundaries of Coulomb electrostatic potential and Woods-Saxon
potential for the nuclear well, including SLBW resonance peaks for all target nuclei (D, T or 3He) [Li et
al 2006,2008, Singh et al 2019].
The deuterium cycle of fusion is composed of several interdependent nuclear reactions [Atzeni and
Meyer-ter-Vehn 2001, Ball 2019]:
2
1 D + 12 D 31T (1.01 MeV) + 1
1 H ( 3.02 MeV)
2 1
1 D + 12 D 23 He (0.82 MeV) + 0 n ( 2.45 MeV)
2 1
1 D + 31T 24 He (3.52 MeV) + 0 n (14.07 MeV)
2
1 D + 23 He 24 He (3.67 MeV) + 1
1 H (14.68 MeV)
6 12 D 4
2 He (3.52 MeV) + 11 H (3.02 MeV) + 01 n (14.07 MeV)
4
2 He (3.67 MeV) + 11 H (14.68 MeV) + 01 n (2.45 MeV) + 1.83 MeV
Furthermore, protons produced by fusion reactions can also react with low probability as
1
1 H + 11 H 2
D + e + + 0.93 MeV
1 (99.76 %)
1 1
1 H + H +e
1
12 D + + 1.95 MeV (0.24 %)
Other fusion reactions of the deuterium cycle with a low branching ratio are [Robouch et al 1993,
Bystritsky et al 1998]
2
1 D + 12 D 4
2 He (0.08 MeV) + γ0(23.77 MeV)
2
1 D + 31T 4
2 He (3.52 MeV) + 01 n (14.07 MeV)
2 3 5
1 D + 1T
2 He* (0.05 MeV) + γ0(16.65 MeV)
2 3 5
1 D + 1T
2 He* (3.2 MeV) + γ1(13.50 MeV)
There are other fusion reactions in which the reaction heat is positive, which have not been
considered, such as
2 1
1 D + 31T 3
2 He +20n
2 3 3 1
1 D + 2 He
2 He + 11 H + 0 n
Table 1 summarizes the main characteristics of the D-cycle fusion: branching ratios (BR), reaction heat
(Q) and emergent particle/gamma energies.
3. Geometric, Gamow-Sommerfeld and S-factor
( E ) 2
k2
with
k 2 E /
m1m2 / m1 m2
The geometric factor ϕ(E) can also be expressed with two independent terms,
2 1
( E )
2 E
The first term is a conversion factor which is included in some expressions in the Gamow-Sommerfeld
or in the S-factor, with units of keV.b in the SI.
3.2.1 Introduction
The Gamow-Sommerfeld factor G(E) is a penetration factor of the Coulomb barrier by the incident
particle and characterize the probability of incident/target nuclei of reaching a fusion reaction. It is
expressed with an exponential attenuation function as [Brennan and Coyne 1964, Humblet et al 1987]
1
G( E ) exp 2l
2
rtp
1
l
k (r ) dr
rn
l
1/ 2
2
kl ( r ) 2 E U ( r )
where U(r) is the potential field, rn is the classical distance of closest approach (nuclear square-well
radius) and rtp is the classical turning point, that is, the distance in which the energy of the incident
particle energy is E U ( rtp ) [Lee and Jung 2017]
3.2.2 Case 1: Duane parametrization
Duane parametrization included an interpolation of the Gamow factor as the Mott’s form of the
Coulomb barrier penetrability [Mott and Massey 1965, NRL 2019]
1
G( E )
exp A1 / E 1
3.2.3 Case 2
2l l 1
U (r ) U C (r )
2 r 2
where UC is the Coulomb potential and the second term is the spin-orbit potential, with l the
magnetic quantum number.
Z1 Z 2 e 2
U C ( r ) ke r rn
r
rn r0 A11/ 3 A21/ 3
with r0 the specific radius per nucleon of fusion reaction and the classical turning point rtp as
The centrifugal term is zero at the boundaries of the nuclear potential well ( l=0), then the integral is
calculated as [Atzeni 2004]
1 Bg E E E
0 arccos
U U
1
2 E 0 0 U 0
where
rtp
U 0 U (rn ) E
rn
and
1/ 2
Bg g 2 k e Z1Z 2e 2 / 2 2
1/ 2
The arccosine can be expanded in powers of E /U 0 , thus
1 B E 1/ 2 1 E 3 / 2 3 E 5 / 2 E E
0 2 g ... 1
E 2 U 0 6 U 0 40 U 0 U 0 U 0
In the low energy limit, with E U 0 , η0 reduces to the Sommerfeld parameter
1 Bg
0
2 E
G ( E ) exp Bg / E
The Sommerfeld parameter can be expressed also as 0 Z1Z 2 c / v , with e 2 / 4 0 c
the fine structure constant, and v the relative velocity of the incident particle, related with the kinetic
energy as, E v 2 / 2 .
3.2.4 Case 3
In some approximations, the Gamow factor is expressed in a similar way to the Sommerfeld
expression as [Yoon and Wong 2000]
2
G( E )
exp 20 1
2
G( E )
exp 2 / k ac 1
2
ac
ke Z1Z 2 e 2
Other expressions have included relativistic considerations about Gamow-Sommefeld factors, which
will be considered in future research [Arbuzov and Kopylova 2012]
3.3. S-factor
3.3.1 Introduction
The S-factor is a function which characterizes the width and energies of the resonance peaks of a
nuclear reaction. The Breit-Wigner formula was firstly applied to the non-relativistic scattering of slow
neutrons with dependence only on resonance energy position and width [Breit and Wigner 1936]
In the case of a single level Breit-Wigner resonance E0, the S-factor is
i f
S (E) 2 2
E E0 / 2
where E0 is the energy of the single-level resonance, Γi and Γf are the partial widths of the entrance
and exit channels of the fusion reaction and
j
j is the total decay width, equal to the width
of the resonance peak at half height [Takano and Ishiguro 1976, Blatt and Weisskopf 1979, Belov et al
2019].
3.3.2 Case 1
The S-factor was interpolated by Duane through a [1/2] order Padé approximation with a constant
term as [Duane 1972, Miley et al 1974, NRL 2019]
A2
S (E) A
A4 A3 E 2 1 5
where the single-level Breit-Wigner (SLBW) resonance is at E0 A4 / A3 and the total resonance
width is 2 / A3 (see table 2) In the case of D+D fusion reactions, in which A5=0, the S-factor
equals the classical Breit-Wigner resonance formula.
3.3.3 Case 2
Further approaches increased the order of the interpolation, through a [4/4] order Padé
approximation as [Bosch and Hale 1992]
A1 E A2 E A3 E A4 EA5
S (E)
1 E B1 E B2 E B3 EB4
Table 3 presents the coefficients for the [4/4] order Padé approximation. In the case of fusion
reactions T(d,n)4He and 3He(d,p)4He, the S-factor was interpolated in two different energy regions:
[0.5-550 keV] and [550-4700 keV] for T(d,n) 4He and [0.3-900 keV] and [900-4800 keV] for
3He(d,p)4He.
3.3.4 Case 3
Let us consider that the Woods-Saxon potential in the nuclear well is modeled as a square-well
complex potential as
U S (r ) U r iU i
where Ur and Ui are the real and imaginary part of the potential [Mohr 1957].
The complex phase shift ω(δ0) of the incident wavefunction is
In this case, the dimensionless S-factor is defined through the function ω(δ0) as [Zhong-Li et al 2004, Li
et al 2008, Jing et al 2009, Singh et al 2019]
4i
S (E) 2
i 1 / 2
2
r
rn r0 A11/ 3 A21/ 3
with r0 the specific radius per nucleon of the nuclear well, which depends on target/incident nuclei.
2
K 2 K r iK i a ib
where
2
a E Ur
2
2
b 2 Ui
K r2 K i2 a
2 K r K i b
Hence,
1/ 2
a a2 b2
K r
2
b
Ki
2K r
( rn ) rn
sin kr ' Krn
cos Krn
cot
sin kr r r n
sin Krn
rn 1
(rn ) 2 cot 0 2 H
ac
then,
ac
cot( 0 ) / 2 cot( ) 2 H
rn
The real and imaginary part of the phase function ω are obtained through
ac
i Im cot( )
rn
ac cos r ii
Im r ii
rn sin r ii
ac cos r cosh i i sin r sinh i
Im r ii
rn sin r cosh i i cos r sinh i
ac cos r cosh i i sin r sinh i sin r cosh i i cos r sinh i
Im r ii
rn sin r cosh i i cos r sinh i sin r cosh i i cos r sinh i
ac sin r cos r (cosh 2 i sinh 2 i ) i sinh i cosh i (sin 2 r cos 2 r )
Im r ii
rn sin 2 r cosh 2 i cos 2 r sinh 2 i
r sin r cos r (cosh i sinh i ) i sinh i cosh i (sin r cos r )
2 2 2 2
a i i sin r cos r (cosh 2 i sinh 2 i ) r sinh i cosh i (sin 2 r cos 2 r )
c Im
rn sin 2 r cosh 2 i cos 2 r sinh 2 i
ac i sin r cos r (cosh 2 i sinh 2 i ) r sinh i cosh i (sin 2 r cos 2 r )
rn
sin 2 r cosh 2 i cos 2 r sinh 2 i
ac i sin 2r r sinh 2i
sin 2 cosh 2 cos 2 sinh 2
2rn r i r i
a
r Re c cot() 2 H
rn
r sin r cos r (cosh 2 i sinh 2 i ) i sinh i cosh i (sin 2 r cos 2 r )
ac ii sin r cos r (cosh 2 i sinh 2 i ) r sinh i cosh i (sin 2 r cos 2 r )
Re 2H
rn sin 2 r cosh 2 i cos 2 r sinh 2 i
ac r sin r cos r (cosh 2 i sinh 2 i ) i sinh i cosh i (sin 2 r cos 2 r )
rn sin 2 r cosh 2 i cos 2 r sinh 2 i 2 H
ac r sin 2r i sinh 2i
2H
2rn sin 2 r 1 sinh 2 i 1 sin 2 r sinh 2 i
ac r sin 2r i sinh 2i
2H
2rn sin 2 r sinh 2 i
Hence,
with A the Euler constant and y(kac) related to the logarithmic derivative of the Γ function given by
y ( x)
' x 1 1
1
A ln( x )
x 1
2
x
n n
n 1
2
x 2
which can be approximated to
1 2
y ( kac ) kac
12
Table 5 presents the nuclear potential well parameters and average atomic radius for the D+D, D+T
and D+3He fusion reactions. Figure 1 shows the nuclear Woods-Saxon and Coulomb electrostatic
potentials for fusion reactions, whereas figures 2 and 3 presents the complex real and imaginary part
of the phase function ω. From the figures, the energies at which ωr=0, corresponding with the SLBW
resonances, are 1039.58 keV, 51.97 keV and 218.84 keV for D+D, D+T and D+ 3He, respectively.
4. Fusion cross-sections
ENDF/B-VIII.0 (Evaluated Nuclear Data File) is the library containing the last revision of experimental
fusion cross-section reactions from Brookhaven National Laboratory, based on accelerator beam-
target experiments with incident particle (proton, deuteron, triton and helium-3) into several targets
(H, D ,T, Helium) [Brown et al 2018]
ENDF/B-VIII.0 libraries are available in the EXFOR database (Experimental Nuclear Reaction Data),
which contains an extensive compilation of experimental nuclear reaction data [Otuka 2014].
Table 5 summarizes all the fusion cross section cases that have been used, including geometric,
Gamow and S-factors. These expressions have been compared with ENDF/B-VIII.0 cross sections data
for fusion reactions of the D-cycle: D(d,p)T, D(d,n)3He, T(d,n) 4He and 3He(d,p)4He.
e
T ( K ) E MeV
kb
where E is the kinetic energy of the incident ions, e the electron charge and kb=1.3807 x 10-23 m2 kg s-2
K-1 the Boltzmann constant.
4.2 Case 1
The fusion cross-section σf (E) was firstly characterized by Duane’s through a 5 parameter expression
as
1 1 A2
f ( E ) A
E exp A1 / E 1 A3 E A4 1
2 5
which assumed the geometric factor as a term dependent only of energy, Gamow factor through
Mott’s form of the Coulomb barrier penetrability and the astrophysical S-factor as a [2/2] order Padé
approximation of the classical Breit-Wigner resonance formula.
4.3 Case 2
In this case, the S-factor is estimated by a [4/4] Padé approximation and Gamow factor by its Gamow
constant,
1 1 A1 E ( A2 E ( A3 E ( A4 EA5 )))
f ( E )
E exp BG / E 1 E ( B1 E ( B2 E ( B3 EB4 )))
4.4 Case 3
1 2 2 4i
f ( E )
2 2
2 2 2
k exp 2 / kac 1
r i 1 /
where 1/χ2 is the Gamow factor and β is a factor which depends on the target nuclei.
5. XSDC-Fusion code
The XSDC-Fusion code is a software to compute fusion cross sections, geometric, Gamow-Sommerfeld
and S-factors in the deuterium cycle (D-cycle) and energy range from 1 keV to 5 MeV, equivalent to
plasma temperatures of 11.6 x 10 6 to 5.80 x 1010 K. The software has been developed in Python 3.8
environment and includes ENDF fusion cross section library and estimates fusion cross-sections,
energy resonances and partial widths (FWHM) of all cases above-mentioned. The XSDC-Fusion code
calculates also the reaction heat (Q) of the fusion reactions and the parameters of the Woods-Saxon
and Coulomb proximity potentials.
Figures 4 to 12 show Gamow-Sommerfeld factors and astrophysical S-factors for different fusion
reactions. Significant differences have been observed between Gamow and S-factors, in particular
with SLBW resonance energy values and Γ (FWHM).
There are considerable differences between case 1 and the other cases considering resonance peak
energy for T(d,n)4He and 3He(d,p)4He reactions. In case 1, energy resonances are placed at 78.7 MeV
and 325.9 MeV, respectively, while for cases 2/3 are placed at 49.1/42 MeV and 215.3/207.8 MeV, as
showed in table 6.
In case 2, the S-factor of the D(d,p)T reaction does not include the Breit-Wigner resonance peak as
cases 1 and 3 in 2798.2 MeV and 931.3 keV, respectively. In addition, case 1 includes a single
resonance at 2798.16 keV for reaction D(d,p)T and 3821.43 keV for reaction D(d,n) 3He, respectively,
whereas case 2 has a resonance at 5012.7 keV for reaction D(d,n) 3He and case 3 has a single
resonance in 931.3 keV for both reactions. As a notation, this energy value is equivalent to the
conversion factor keV and uma, although no physical correlation has been observed between them.
Furthermore, D+D fusion reaction for case 3 is independent of reaction products (see fig. 11), while
other cases have different expressions from D(d,p)T and D(d,n) 3He reactions.
Figure 13 presents ENDF/B-VIII.0 fusion cross section data obtained with accelerator-based beam-
target experiments in Brookhaven National Laboratory. These fusion cross sections have been used as
reference values to compare with other fusion cross-section equations (cases 1, 2 and 3).
Figures 14, 15 and 16 show fusion cross section for D+D, D+T and D+ 3He evaluated through cases 1, 2
and 3, whereas table 6 summarizes resonance energies for all cases and fusion reactions and table 7
shows cross-section maximum values and energy Emax. As observed, resonance peaks are mostly
attenuated in all cases and shifted from the energy at which is placed the maximum cross-section
values.
Fusion cross section differences are relatively lower between all cases under study (< 5 %) in the
energy range of [0.001, 5] MeV, compared with ENDF/B-VIII.0, as observed in figures 17, 18 and 19.
In addition, the energy position of the maximum value of fusion cross-section is also shifted between
cases. In cases 2 and 3, fusion reaction 3He(d,p)4He has a saw profile at energies lower than 10 keV.
7. Conclusions
During decades, fusion cross-sections have been estimated with beam-target experiments on
accelerators and interpolated through several parametric equations to quantum mechanical models.
Fusion cross-sections (σ), S-factors and branching ratios (BR) from these experiments should be
compared with real conditions in tokamak and stellerator fusion reactors, in which target particles are
not in rest and have similar kinetic and potential energies of incident particles.
S-factors characterize fusion reactions in a more detailed way than cross sections, showing SLBW
resonance peaks at different energies. However, there are considerable differences between
resonance energies and Γ (FWHM) as observed.
Furthermore, although there are other types of Wood-Saxon proximity potentials instead of the
square-well potential (i.e. optical model), those models have been applied to fusion of heavy nuclei
(Z>8) [Chepurnov 1967, Denisov 2002, Aygun 2018]
In conclusion, fusion reaction models for light nuclei (deuterium, tritium and helium) should be
reviewed in order to apply fusion to energy production in safety conditions.
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Tables
Table 1 - Fusion reactions of the D-cycle between deuterium and other light nuclei
[Langenbrunner et al 1990, Jing et al 2009, Kiptily 2014, Ongena 2016]
Energy released per reaction product
Reaction BRi Q (MeV) [MeV]
(a) (b)
T+p ~ 0.45 -4.03 1.01 3.02
3
D+D He+n ~ 0.55 -3.27 0.82 2.45
4
He+γ 10-7 -10-6 -23.85 0.08 23.77
3
He+2n - +2.98 - -
4
The D-cycle D+T He+n ~1 -17.59 3.52 14.07
5
He+γ(a) 5x10-5 - 5x10-4 -16.70 0.05 / 3.2 16.65 / 13.50
3
He+p+n - +2.22 - -
D+3He 4
He+p ~1 -18.35 3.67 14.68
5
Li+γ (b) 5x10-5 - 5x10-4 -16.39 0.05 16.34
(a) D+T branching ratio by inertial confinement fusion (ICF) [Kim et al 2012]
(b) D+3He branching ratio on JT-60U tokamak [Nishitani et al 2000]
T(d,n)4He 3
He(d,p)4He
D(d,p)T D(d,n)3He Units
[0.5-550 keV] [550-4700 keV] [0.3-900 keV] [900-4800 keV]
BG 31.3970 31.3970 34.3827 34.3827 68.7508 68.7508 keV1/2
A1 5.5576 x 104 5.3701 x 104 6.927 x 104 -1.4714 x 106 5.7501 x 106 -8.3993 x 105 keV.mb
A2 2.1054 x 102 3.3027 x 102 7.454 x 108 0.0 2.5226x 103 0.0 mb
A3 -3.2638 x 10-2 -1.2706 x 10-1 2.050 x 106 0.0 4.5566x 101 0.0 mb.keV-1
A4 1.4987 x 10-6 2.9327 x 10-5 5.2002 x 104 0.0 0.0 0.0 mb.keV-2
A5 1.8181 x 10-10 -2.5151 x 10-9 0.0 0.0 0.0 0.0 mb.keV-3
B1 0.0 0.0 6.38 x 101 -8.4127 x 10-3 -3.1995 x 10-3 -2.6830 x 10-3 keV-1
B2 0.0 0.0 -9.95 x 10-1 4.7983 x 10-6 -8.5530 x 10-6 1.1633 x 10-6 keV-2
B3 0.0 0.0 6.981 x 10-5 -1.0748 x 10-9 5.9014 x 10-8 -2.1332 x 10-10 keV-3
B4 0.0 0.0 1.728 x 10-4 8.5184 x 10-14 0.0 1.4250 x 10-14 keV-4
β 2 2 2 2 -
Table 5 - Comparison of geometric, Gamow and S-factors of several fusion cross-section expressions
kac 2 1 / 2 2
with phase shift ω(δ0) 2008]
r i boundary conditions
Coulomb
barrier
Turning point
E=UC(r)
projectile
Tunneling
Fusion
Figure 1 - Woods-Saxon square-well (left) and Coulomb electrostatic proximity potential (right)
for fusion reactions
Figure 8 - S-factor of D+T and D+3He fusion reactions as a function of center-of-mass energy E (Case 1)
Figure 9 - S-factor for D+D fusion reaction as a function of center-of-mass energy E (Case 2)
Figure 10 - S-factor for D+T and D+3He fusion reactions as a function of center-of-mass energy E (Case 2)
Figure 11 - S-function for D+D fusion reaction as a function of center-of-mass energy E (Case 3)
Figure 12 - S-function for D+T/D+3He fusion reactions as a function of center-of-mass energy E (Case 3)
Figure 13 - Fusion cross-sections for D+D/D+T/D+ 3He reactions as a function of center-of-mass energy E from
ENDF/B-VIII.0 (Reference)
Figure 14 - Fusion cross-sections for D+D/D+T/D+3He reactions as a function of center-of-mass energy E (Case 1)
Figure 15 - Fusion cross-sections for D+D/D+T/D+3He reactions as a function of center-of-mass energy E (Case 2)
Figure 16 - Fusion cross-sections for D+D/D+T/D+3He reactions as a function of center-of-mass energy E (Case 3)
Figure 17 - Relative differences of fusion cross-sections between case 1 formula and ENDF