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thanks: Current address: Gyeonghae girl’s high school, Jinju 52651, Korea

]Received 24 June 2022

Fragment productions in DJBUU and SQMD: comparative study

Dae Ik Kim [email protected] Department of Physics, Pusan National University, Busan 46241, Korea    Kyungil Kim Rare Isotope Science Project, Institute for Basic Science, Daejeon 34000, Korea    Chang-Hwan Lee [email protected] Department of Physics, Pusan National University, Busan 46241, Korea    Youngman Kim Rare Isotope Science Project, Institute for Basic Science, Daejeon 34000, Korea    Sangyong Jeon Department of Physics, McGill University, Montreal, Quebec, Canada H3A2T8
([)
Abstract

We study 208Pb+40,48Ca reactions at EbeamE_{\rm beam} = 50, 100 AMeV with DJBUU and SQMD transport codes. We compare the large primary fragments from the two codes at the end of the simulation time. We observe that overall the two models produce similar fragments. However, we see a noticeable difference between DJBUU and SQMD at Ebeam=100E_{\rm beam}=100 AMeV with the impact parameter bb = 0 fm and discuss this difference in terms of the difference in the equation of state adopted in the two models and the difference in stability inherent to the BUU-type and QMD-type models.

Rare Isotope Science, Heavy Ion Reaction, Fragment

I Introduction

Worldwide, there are many new rare isotope production facilities coming online in the foreseeable future. One of the new facilities under construction is RAON (Rare isotope Accelerator complex for ON-line experiments) by the Rare Isotope Science Project(RISP) of Institute for Basic Science (IBS) in Korea Tshoo:2013voa . RAON will provide an ample amount of exotic neutron- and proton-rich isotopes and enrich various advanced research fields: nuclear physics, astrophysics, and applications in medical, material, and biological science. For a brief summary of RAON physics, see Jeong:2018qvi .

The evolution of rare isotope (RI) science evolves through interplay between three basic ingredients: experiment, simulation and theory. To make a major progress in RI science, we must make use of all the three approaches. A good example is the nuclear symmetry energy. The nuclear symmetry energy originates from the difference in the proton and the neutron numbers in dense nuclear matter or nuclei and it is an important physical quantity in understanding the properties of finite nuclei such as the neutron-skin thickness of heavy nuclei, neutron star properties and the collapse of the core of a massive star. The nuclear symmetry energy may also play an important role in modeling the r-process nucleosynthesis. To study the symmetry energy in a terrestrial environment laboratory, we perform heavy ion collision experiments at RI facilities such as RAON. To connect experimentally observed quantities such as neutron to proton ratios are then compared with nuclear transport model calculations. The two transport models we are using in this study, DaeJeon Boltzmann-Uehling-Uhlenbeck (DJBUU) and Sindong Quantum Molecular Dynamics (SQMD), are general purpose models for low-to-intermediate energy heavy ion collisions but the primary thrust for developing them has been to support physics outcome at RAON.

In this work we compare features of BUU- and QMD-type transport models in general and specifically DJBUU and SQMD by studying fragment productions from the both models. For this we study fragment productions in 208Pb+40Ca and 208Pb+48Ca reactions at 5050 and 100100 AMeV with the impact parameters b=0,3,6b=0,~{}3,~{}6 fm. Since the most direct comparison of different transport models is to compare primary fragments before using an afterburner in the simulations, we focus on the primary fragments from DJBUU and SQMD. For fragment production simulations in heavy ion reactions, we refer to Mocko:2008rj ; Gaitanos:2007mm ; Napolitani:2009pc ; Liu:2014poa .

II Model descriptions

Transport theory describes the dynamics of nuclear collisions at Fermi/intermediate energies semi-classically. The key quantity is the phase space density (coordinate and momentum distribution). Transport simulations in general take the following steps: initialization of the projectile and target nuclei, propagation of the (test) particles, hadron-hadron scatterings with Pauli blocking.

There are two complimentary transport model approaches. The first one is the BUU-type models whose goal is to calculate the one-body phase space distribution. Due to the test-particle ansatz and the mean-field potential, the BUU-type model is deterministic and contains no fluctuations except the numerical ones. The second one is the QMD-type models that are based on an N-body Hamiltonian. As the QMD models do not use the test particle method, they are better suited for event-by-event analysis of heavy ion collisions.

In the next section, we will briefly describe the DJBUU model and the SQMD model. For more details on these models we refer to DJBUU2016 ; Kim:2020sjy for DJBUU and Kim:2017hmt for SQMD. For a recent review of most of the transport models that are currently being used in low-to-medium energy heavy ion collisions, see TMEP:2022xjg .

II.1 DJBUU model

DJBUU mostly uses widely accepted standard methods in transport theory. One distinctive feature is the profile function of the test particle

g(𝐮)=g(u)=𝒩m,n(1(u/a)m)nfor 0<u/a<1g({\bf u})=g(u)={\cal N}_{m,n}(1-(u/a)^{m})^{n}\ \ \ \hbox{for}\ 0<u/a<1 (1)

where u=|𝐮|u=|{\bf u}| is either the displacement vector or the relative momentum, 𝒩m,n{\cal N}_{m,n} is the normalization constant, and m>1m>1 and n>1n>1 are positive integers. The parameter aa controls the width of the function and for |u/a|>1|u/a|>1, g(u)=0g(u)=0. Unlike the usual gaussian profile function, g(u)g(u) vanishes smoothly at u=au=a and it is exactly integrable. The default values are m=2m=2, n=3n=3 and ax=4.2fma_{x}=4.2\,\hbox{fm} for the position profile and ap=s/axa_{p}=s\hbar/a_{x} for the momentum profile with s0.6s\approx 0.6.

Another feature of the DJBUU model is the mean field potential. In addition to a widely-used Walecka type relativistic mean field potential, we use a relativistic mean field potential obtained from an extended parity doublet model  Motohiro:2015taa ; Shin:2018axs ; Takeda:2017mrm to study the origin of the baryon mass and partial chiral symmetry restoration in dense nuclear matter. In this model, the scalar field is the chiral partner of the pion field.

Now, we describe how we identify the produced fragments in DJBUU. Since the BUU-type models use the test particle method, it is in general not easy to define a nucleon cluster as a single isotope. We remark here that to identify a light cluster whose mass number is smaller than four, the composition production method was employed in the collision terms  Danielewicz:1992mi .

Within the energy range in which we are interested, a large cluster will form near the center of a collision. As such, we identify the cluster as follows in DJBUU simulations. During our simulations, we span three-dimensional space of -80.0 fm << xx, yy, zz << 80.0 fm in the center of mass frame by dividing the space into 160×160×160160\times 160\times 160 unit cells of 1 fm3\hbox{fm}^{3} volume. Then, we search for all cells that has the the baryon density equal to or larger than 0.1ρ00.1\,\rho_{0} where the nuclear saturation density ρ0=0.17\rho_{0}=0.17 fm-3. Once we find all such cells, we regard the collection of these cells as a cluster or a fragment and count all the test particles for protons and neutrons in the cluster. The total number of the test particles is then divided by the number of the test particle used in our simulation (100 in the current study) to assign the proton and neutron numbers of the cluster. The value of the proton and neutron of a cluster is rounded up to the nearest integer. We should mention here that since DJBUU and also other transport models do not include nuclear pairing effects, which are essential for the odd-even staggering in nuclei, there is an inherent uncertainty in assigning the proton and neutron numbers to the cluster.

II.2 SQMD model

In SQMD a standard gaussian type of the nucleon wave function is used,

ψi(r,t)=1(2πσr2)3/4exp((rri)24σr2+i(pir)),\displaystyle\psi_{i}(\vec{r},t)=\frac{1}{(2\pi\sigma_{r}^{2})^{3/4}}\exp\left(-\frac{(\vec{r}-\vec{r_{i}})^{2}}{4\sigma_{r}^{2}}+\frac{i}{\hbar}(\vec{p_{i}}\cdot\vec{r})\right)\,, (2)

where rir_{i} and pip_{i} are the position and the momentum of the iith nucleon center, respectively. σr\sigma_{r} is the width of a single nucleon in the coordinate space. We use σr=1.3\sigma_{r}=1.3 fm to ensure the stability of the initialized nuclei.

The interaction among nucleons is described by the Skyrme potential which has been widely used in the QMD models such as Aichelin:1991xy ; Papa:2002xqa . The Hamiltonian is given by

H\displaystyle H =ipi22mi+Utot,\displaystyle=\sum_{i}\frac{\vec{p}_{i}^{2}}{2m_{i}}+U_{\rm tot}, (3)
Utot\displaystyle U_{\rm tot} =USkyrme+Usurf+Usym+Ucoul,\displaystyle=U_{\rm Skyrme}+U_{\rm surf}+U_{\rm sym}+U_{\rm coul}\,, (4)

where mim_{i} is the mass of the ii-th nucleon. The density dependent Skyrme interaction term is given by

USkyrme=α2(ρρ0)+βγ+1(ρρ0)γ,\displaystyle U_{\rm Skyrme}=\frac{\alpha}{2}\left(\frac{\rho}{\rho_{0}}\right)+\frac{\beta}{\gamma+1}\left(\frac{\rho}{\rho_{0}}\right)^{\gamma}\;, (5)

where ρ\rho is the baryon number density. We take α=218\alpha=-218 MeV, β=164\beta=164 MeV and γ=4/3\gamma=4/3. With these parameters we obtain the incompressibility KK=236 MeV and the binding energy 16-16 MeV at the saturation density. For initialization, propagation and collision, SQMD adopts the standard methods used in transport models Kim:2017hmt .

In SQMD simulations, we identify clusters using the Minimum Spanning Tree (MST) algorithm. After a collision, we measure the distances among all the nucleons and connect two nucleons with the minimum distance to span all nucleons with the shortest distance. If the minimum distance of a nucleon pair is longer than 3.53.5 fm, then the two nucleons are not connected. We identify the connected lumps as primary fragments.

III Results

In this section, we compare the “biggest fragments (BFs)” in DJBUU and SQMD simulations. Here, the BF means the fragment that has the largest mass number in each simulated event and the BFs means the aggregation of the BF from each simulation. As described in the previous section, DJBUU and SQMD use different methods to define the fragments.

We recall that DJBUU uses the test-particle method. In this method, each simulated event contains an ensemble of events. When calculating physical quantities such as baryon number densities, we effectively average over the ensemble in each time step. The BF in DJBUU means the largest cluster formed near the center of a collision at the end of the simulation time, and the BFs in our study is the collection of the BF from ten runs. While, the BF in SQMD is the fragment which has the largest mass number among fragments at the end of the simulation time, and the BFs are the aggregation of such a BF from ten-thousand runs.

We simulate 208Pb+40Ca and 208Pb+48Ca reactions at 5050 and 100100 AMeV with the impact parameters b=0,3,6b=0,3,6 fm. Both in DJBUU and SQMD, the initialized projectile and target are placed 1616 fm apart from each other. Here, 16 fm is the distance between the center of the projectile and target. Then, we do the simulations until t=300t=300 fm/c. In the case of DJBUU, we use one hundred test particles for each nucleon and perform ten runs. We perform ten thousand runs for the SQMD simulations and also check some of our results with twenty-thousand runs to confirm that the results are robust against the number of runs. Since we are interested only in the central region we plot up to 2020 fm in each of the transverse directions.

In Fig. 1, the density distributions of three different systems are shown up to 300300 fm/c simulation time; from the top to bottom, 208Pb+40Ca at EbeamE_{\rm beam} = 50 AMeV, 208Pb+40Ca at EbeamE_{\rm beam} = 100 AMeV and 208Pb+48Ca at EbeamE_{\rm beam} = 50 AMeV. We observe that the 208Pb+48Ca and 208Pb+40Ca reactions at EbeamE_{\rm beam} = 100 AMeV show a similar trend and therefore we plot only the case with 40Ca target at EbeamE_{\rm beam} = 100 AMeV. For comparison, the results of DJBUU and SQMD are plotted alternatively, and contours for different impact parameters are displayed, bb = 0 fm in the first two rows, 33 fm in the middle, 66 fm in the last. Here, the colors denote baryon number density, and the density is averaged for whole simulation events.

It can be seen from Fig. 1 that when EbeamE_{\rm beam} = 50 AMeV, the density has a maximum value near t=40t=40 fm/c. When EbeamE_{\rm beam} = 100 AMeV, it has the highest value near t=30t=30fm/c, as expected. A significant difference between DJBUU and SQMD is the central density. Generally, the BUU-type models have higher stability than QMD-type models, which contributes to the difference. Also, the difference is partly attributed to the equation of state of nuclear matter adopted in DJBUU and SQMD.

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Figure 1: Density distribution in the collision plane. For comparison, the results of DJBUU and SQMD are shown alternatively. From top to bottom, the systems are 208Pb+40Ca at EbeamE_{\rm beam} = 50 AMeV (top), 208Pb+40Ca at EbeamE_{\rm beam} = 100 AMeV (middle) and 208Pb+48Ca at EbeamE_{\rm beam} = 50 AMeV (bottom), respectively. In each figure, impact parameters are b=0b=0 fm in the first two lows, b=3b=3 fm in the middle, and b=6b=6 fm in the last two lows, Central region is plotted up to 2020 fm for the xx and zz directions. The colors denote the baryon number density in unit of ρ0\rho_{0}.
Table 1: The BFs in DJBUU and SQMD; the BFs from the ten runs of DJBUU and the most abundantly produced three BFs from SQMD runs.
Target
EbeamE_{\rm beam}
[AMeV]
b
[fm]
DJBUU SQMD
40Ca 50 0 73163{}^{163}_{73}Ta, 73162{}^{162}_{73}Ta, 73164{}^{164}_{73}Ta, 74163{}^{163}_{74}W 69163{}^{163}_{69}Tm, 74173{}^{173}_{74}W, 72169{}^{169}_{72}Hf
3 73163{}^{163}_{73}Ta, 74165{}^{165}_{74}W, 73164{}^{164}_{73}Ta, 72169{}^{169}_{72}Hf, 74173{}^{173}_{74}W, 74172{}^{172}_{74}W
6 74167{}^{167}_{74}W, 75169{}^{169}_{75}Re, 73165{}^{165}_{73}Ta, 75168{}^{168}_{75}Re 72168{}^{168}_{72}Hf, 70164{}^{164}_{70}Yb, 72169{}^{169}_{72}Hf
100 0 56123{}^{123}_{56}Ba, 55121{}^{121}_{55}Cs, 57124{}^{124}_{57}La, 56122{}^{122}_{56}Ba, 56124{}^{124}_{56}Ba 3378{}^{78}_{33}As, 50114{}^{114}_{50}Sn, 54124{}^{124}_{54}Xe
3 59130{}^{130}_{59}Pr, 58130{}^{130}_{58}Ce, 57128{}^{128}_{57}La, 58128{}^{128}_{58}Ce, 58129{}^{129}_{58}Ce, 58127{}^{127}_{58}Ce, 57127{}^{127}_{57}La 53125{}^{125}_{53}I, 56128{}^{128}_{56}Ba, 57132{}^{132}_{57}La
6 64145{}^{145}_{64}Gd,64144{}^{144}_{64}Gd,65146{}^{146}_{65}Tb,65147{}^{147}_{65}Tb 64151{}^{151}_{64}Gd,63149{}^{149}_{63}Eu,66154{}^{154}_{66}Dy
48Ca 50 0 72161{}^{161}_{72}Hf,72162{}^{162}_{72}Hf,71160{}^{160}_{71}Lu,71159{}^{159}_{71}Lu 70167{}^{167}_{70}Yb,71167{}^{167}_{71}Lu,71170{}^{170}_{71}Lu
3 72162{}^{162}_{72}Hf,73164{}^{164}_{73}Ta 70165{}^{165}_{70}Yb,70167{}^{167}_{70}Yb,71167{}^{167}_{71}Lu
6 72164{}^{164}_{72}Hf,72163{}^{163}_{72}Hf,73166{}^{166}_{73}Ta,72165{}^{165}_{72}Hf 69165{}^{165}_{69}Tm,68159{}^{159}_{68}Er,69164{}^{164}_{69}Tm
100 0 51113{}^{113}_{51}Sb,52115{}^{115}_{52}Te,51114{}^{114}_{51}Sb,52116{}^{116}_{52}Te,51112{}^{112}_{51}Sb 2558{}^{58}_{25}Mn,3274{}^{74}_{32}Ge,48107{}^{107}_{48}Pd
3 54121{}^{121}_{54}Xe,55122{}^{122}_{55}Cs,54120{}^{120}_{54}Xe,55123{}^{123}_{55}Cs,55121{}^{121}_{55}Cs 52120{}^{120}_{52}Te,45106{}^{106}_{45}Rh,48113{}^{113}_{48}Cd
6 62140{}^{140}_{62}Sm,62139{}^{139}_{62}Sm,61138{}^{138}_{61}Pm,61137{}^{137}_{61}Pm,60137{}^{137}_{60}Nd 62147{}^{147}_{62}Sm,64153{}^{153}_{64}Gd,62148{}^{148}_{62}Sm

In Table 1, the BFs from DJBUU and SQMD simulations are shown. All the BFs from the ten runs are presented for DJBUU; while the most abundantly produced three BFs are listed for SQMD. It can be seen from Table 1 that as the beam energy increases from 5050 AMeV to 100100 AMeV, the difference in the produced BFs between DJBUU and SQMD, especially when b=0b=0 fm, becomes significant. This is partly because the difference in the equations of state adopted in DJBUU and SQMD is more pronounced at higher beam energies since the maximum density becomes larger as the bean energy increase. For example, the symmetry energy used in DJBUU and SQMD can be written as

E(ρ,αI)\displaystyle E(\rho,\alpha_{I}) =E(αI=0)+EsymαI2+,\displaystyle=E(\alpha_{I}=0)+E_{\rm sym}\alpha_{I}^{2}+\cdots, (6)
Esym\displaystyle E_{\rm sym} =gsym(ρρ0)σ,\displaystyle=g_{\rm sym}\left(\frac{\rho}{\rho_{0}}\right)^{\sigma}\,, (7)

where αI\alpha_{I} is the isospin asymmetry defined by αI=(ρnρp)/(ρn+ρp)\alpha_{I}=(\rho_{n}-\rho_{p})/(\rho_{n}+\rho_{p}). In this study σ=1\sigma=1 and σ=0.7\sigma=0.7 are used for DJBUU Liu:2001iz and SQMD, respectively. We will discuss the symmetry energy more at the end of this section. Also, since the beam energy (100100 AMeV) would be high enough to break nuclei into small pieces, the different definitions of the BF in DJBUU and SQMD can be more pronounced at the higher beam energy. It can be partly responsible for the difference in the BF distributions.

Another trend in Table 1 is that with a fixed beam energy the difference in the produced BFs between DJBUU and SQMD increases as the impact parameter decreases. This is related to the collision dynamics and the equation of state. At the central collisions (b=0b=0 fm), almost all the nucleons participate in the collisions. Therefore the bulk of the system evolution depends sensitively on the equation of state. At the peripheral collisions (b=6b=6 fm), however, substantial number of nucleons do not participate in the collision directly. Hence, the part of the system that can feel the equation of state is relatively smaller.

Refer to caption
Figure 2: Proton and neutron distributions of the BFs in SQMD for 208Pb+40Ca reaction at EbeamE_{\rm beam} = 100 AMeV. From left to right, the impact parameters are bb = 0 fm (left), 3 fm (center) and 6 fm (right), respectly.
Refer to caption
Figure 3: The same as Fig. 2 for 208Pb+48Ca reaction.

To investigate some features of the BFs produced in SQMD, we show the proton and neutron distributions of the BFs in SQMD for 208Pb+40Ca and 208Pb+48Ca reactions at EbeamE_{\rm beam} = 100 AMeV in Fig. 2 and Fig. 3, respectively. From the left to the right, we plot the distributions with the impact parameters 0, 3 and 6 fm. The colors denotes the total number of the produced BF in ten-thousand simulation events. A trend we can observe in Fig. 2 and Fig. 3 is that for the central collisions (bb = 0 fm), the ranges of proton and neutron numbers are relatively wide, while those become narrow for the peripheral collisions (bb = 6 fm). One of the interesting results is that, even though the neutron number of the system is increased and the bombarding energy in the center of mass frame is decreased from the reaction 208Pb+40Ca to 208Pb+48Ca, the proton and neutron numbers of the BFs for 208Pb+48Ca reactions are smaller than those for 208Pb+40Ca reactions at EbeamE_{\rm beam} = 100 AMeV. One way to understand this phenomenon is the role of the nuclear symmetry energy. This effect is more significant in the 208Pb+48Ca reactions than 208Pb+40Ca reactions. In a neutron-rich matter, the symmetry energy pushes out the neutrons and so disturbs the formation of large fragments. To check the effect of the symmetry energy, we calculate the baryon density and the isospin asymmetry αI\alpha_{I} as a function of time at the collision center and show them in Fig. 4. Note that as in Eq. (6), in the expression of the energy of a system, the symmetry energy EsymE_{\rm sym} comes with the isospin asymmetry as EsymαI2E_{\rm sym}\alpha_{I}^{2}. As can be seen in the right panel of Fig. 4, the isospin asymmetry in the 208Pb+48Ca reaction is overall bigger that the one in the 208Pb+40Ca reaction. Therefore, we expect that the role of the symmetry energy is more pronounced in the 208Pb+48Ca reaction, resulting in smaller BFs compared to the 208Pb+40Ca reaction.

Refer to caption
Refer to caption
Figure 4: Baryon number density(left) and isospin asymmetry(right) as a function of the simulation time at the collision center for the central collsions (bb = 0 fm). Black and red lines are for 208Pb+48Ca and 208Pb+40Ca reactions with Ebeam=100E_{\rm beam}=100 AMeV, and blue and green lines are for 208Pb+48Ca and 208Pb+40Ca reactions with Ebeam=50E_{\rm beam}=50 AMeV.

IV Summary

In this work, we have compared two transport model codes DJBUU and SQMD. Both models have been developed mainly for RAON physics where one of the main goals is to produce rare isotope. To this end, we have investigated the fragment productions in 208Pb+40Ca and 208Pb+48Ca reactions at 5050 and 100100 AMeV with the impact parameters b=0,3,6b=0,~{}3,~{}6 fm, focusing on primary fragments from DJBUU and SQMD. We observed that overall the two models produce similar fragments. For example, though the fragments with 48Ca are a bit smaller than those with 40Ca, the produced fragments from the both models are in the range of A=162168{\rm A}=162\sim 168 with Z=7074{\rm Z}=70\sim 74, where A is the atomic number and Z is the charge number. We found a noticeable difference between DJBUU and SQMD at Ebeam=100E_{\rm beam}=100 AMeV with bb = 0 fm, which can be attributed to the difference in the equation of state used in the models and also to the difference in stability inherent to the BUU-type and QMD-type models. After some improvements such as including a surface term (time-dependent width of the nucleons) in DJBUU (SQMD), DJBUU and SQMD will play important roles in studying heavy ion reactions and related physics.

Acknowledgements.
The work of D.I.K. and C.H.L. was supported by National Research Foundation of Korea (NRF) grants funded by the Korea government (Ministry of Science and ICT and Ministry of Education) (No. 2016R1A5A1013277 and No. 2018R1D1A1B07048599). The work of K.K. and Y.K. was supported partly by the Rare Isotope Science Project of Institute for Basic Science funded by Ministry of Science, ICT and Future Planning, and NRF of Korea (2013M7A1A1075764). This work was supported by the National Supercomputing Center with supercomputing resources including technical support(KSC-2021-CRE-0477 and KSC-2021-RND-0076). S.J. is supported in part by the Natural Sciences and Engineering Research Council of Canada.

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