Influence of Nuclear Deformation on the Potential Energy Surface in Di—Nuclear Model

Influence of the nuclear deformation on the potential energy surface(PES) in a di-nuclear system is studied in details.It is found that the PES shape changes greatly due to the deformation effect.The top point of the PES could be reduced significantly,which implies that the optimum excitation energy could also be reduced greatly and may enhance the fromation probability of the compound nucleus.The dynamical deformaiton as a function of the reaction time in the reaction process is dramatic.The Z/N ratios of fragments tend to follow that of the compound nucleus during the nucleon exchange process,but to fluctuate.     

生成超重核的熔合反应中的动力学形变效应

利用包含动力学势能面的双核模型对超重核的生成机制中的一些问题进行了研究。对双核系统的粒子交换势能面进行的计算结果表明,反应过程中原子核动力学形变对于粒子交换势能面的结构有显著的影响。进一步计算了生成超重核的熔合几率,结果显示,原子核的动力学形变导致内熔合位垒升高,进而明显降低了生成超重核的熔合几率。Some aspects in the fusion mechanism for the production of superheavy nuclei are investigated with the dinuclear system model with dynamical potential energy surface. The calculation results about the potential energy surface indicate that the inclusion of nuclear dynamical deformation affects the structure of potential energy surface significantly.The investigation on the fusion probability to synthesize superheavy nuclei indicates that the fusion probability decreases significantly due to the increase of the inner fusion barrier for the inclusion of the nuclear dynamical deformation.     

重离子熔合反应系统中的准裂变(英文)

在重离子熔合反应中,准裂变与熔合过程之间相互竞争。在双核模型中,常常在主方程中加入Kramers公式来描述准裂变。但只有当准裂变位垒足够高时,该公式才能成立。在本工作中,把弹靶核的间距作为独立的动力学变量,通过求解主方程来自洽地同时描述双核模型向全熔合和准裂变过程的演化,因此检验了Kramers 公式的适用条件。此外,在重离子熔合反应过程中,把动力学形变的演化和核子的转移过程都看成是耗散过程,在系统的势能面的约束下,同时求解含有动力学形变参量和质量不对称度参量的一系列主方程。研究显示了动力学形变对准裂变质量分布的直接影响,得到了与实验观测值符合得很好的计算结果。In heavy ion fusion reactions, the quasifission(QF) is competing with fusion, and which is often described by incorporating the Kramers formula(KRA-F) into the master equation(ME) within the Di-Nuclear System(DNS) model. However the KRA-F works well only if the QF barrier is high enough. Presently by takingthe relative distance of nuclei as an independent dynamical variable, the evolution of the DNS towards fusion and QF are both treated as a diffusion process in a consistent way by solving MEs. The validity of the KRA-F is thuschecked. Furthermore, the dynamical deformation and the nucleon transfer in heavy ion fusion reaction process are viewed simultaneously as a diffusion process, and are treated by solving a set of MEs with the variables of thequadrupole deformation of each nucleus and the mass asymmetry variable in the potential energy surface(PES) of the system. The distinct influence of the dynamical deformation on the QF mass yield distribution is discussed,and the experimental observations can be well reproduced by the calculation.     

Shell Correction and Pairing Energies in the Dinuclear System Model

We investigate the dependences of the potential energy surfaces （PES） and the fusion probabilities for some cold fusion reactions leading to super-heavy elements on the nuclear shell effect and pairing energy. It is found that the shell effect plays an important role in the fusion of the super-heavy element while pairing energy＇s contribution is insignificant. The fusion probabilities and evaporation residue cross sections as functions of the Ge-isotope projectile bombarding ^208Pb are also investigated. It is found that evaporation residue cross sections do not always increase with the increasing neutron number of Ge-isotope.     

A transient process observation method based on the non-homogeneous Poisson process model

The current-mode-counting method is a new approach to observing transient processes,especially in transient nuclear fusion,based on the non-homogeneous Poisson process(NHPP)model.In this paper,a new measurement process model of the pulsed radiation field produced by transient nuclear fusion is built based on the NHPP.A simulated measurement is performed using the model,and the current signal from the detector is obtained by simulation based on Poisson process thinning.The neutron time spectrum is reconstructed and is in good agreement with the theoretical value,with its maximum error of a characteristic parameter less than 2.3%.Verification experiments were carried out on a CPNG-6 device at the China Institute of Atomic Energy,with a detection system with a nanosecond response time.The experimental charge amplitude spectra are in good agreement with those obtained by the traditional counting mode,and the characteristic parameters of the time spectrum are in good agreement with the theoretical values.This shows that the current-mode-counting method is effective for the observation of transient nuclear fusion processes.     

Measurement of anomalous nuclear reaction in deuterium-loaded metal

This paper reports on an experiment for testing natural nuclear fusion at low temperature searching for evidence of the origin of ³He from natural nuclear fusion in deep Earth. The experiment was carried out using deuterium-loaded titanium foil samples and powder sample. Detection of charged particle was carried out using a low-level charged particle spectrometer. An Al foil was used as an energy absorber for identification of charged particle. Although the counting rate is very low in the experiment, the emission of energetic particle from the sample is observed and the particle is identified as a proton having energy about 2.8 MeV after exiting the titanium sample. This work provides a positive result for the emission of charged particle in the deuterium-loaded titanium foil samples at low temperature, but a negative result for the deuterium-loaded titanium powder sample. The average reaction yield is deduced to be (0.46±0.08) protons/h for the foil samples. With the suggestion that the proton originates from d--d reaction, we calculate the reaction rate for d--d reaction, and the obtained result is 1.4× 10^-24 fusion/d--d\cdot sec. The negative result of the deuterium-loaded titanium powder sample suggests that the reaction yield might be correlated with the density or microscopic variables of deuterium-loaded titanium materials. The negative result also indicates that d--d reaction catalysed by μ-meson from cosmic ray can be excluded in the samples in this experiment.     

原子核配对壳模型——侵入态与原子核形变

利用原子核配对壳模型讨论了侵入态对原子核形变的影响.计算结果表明,侵入态具有削弱原子核形变的趋势,对原子核的形变起着重要作用. The influence of intruder level on nuclear deformation is studied within the framework of the nucleon-pair shell model truncated to an SD-pair subspace. The results suggest that the intruder level has a tendency to reduce the deformation and plays an important role in determining the onset of rotational behavior.     

Fusion Barrier of Super-heavy Elements in a Generalized Liquid Drop Model

The macroscopic deformed potential energies for super-heavy elements Z = 110,112,114,116,118 arc determined within a generalized liquid drop model (GLDM). A quasi-molecular mechanism is introduced to describe the deformation of a nucleus in the GLDM and the shell model simultaneously. The macroscopic energy of a twocenter nuclear system in the GLDM includes the volume-, surface-, and Coulomb-energies, the proximity effect at each mass asymmetry, and accurate nuclear radius. The shell correction is calculated by the Strutinsky method and the microscopic single particle energies are derived from a shell model in an axially deformed Woods-Saxon potential with the quasi-molecular shape. The total potential energy of a nucleus can be calculated by the macro-microscopic method as the summation of the liquid-drop energy and the Strutinsky shell correction. The theory is applied to predict the fusion barriers of the cold reactions ^64Ni ^208 spb → ^272 110*, ^70Zn ^208pb → ^278 112*, ^76Ge ^208seb → ^284 114*,^82Se ^208pb → ^29 116*, ^86Kr ^208pb → ^294 118*. It is found that the neck in the quasi-molecular shape is responsible for the deep valley of the fusion barrier. In the cold fusion path, double-hump fusion barriers could be predicted by the shell corrections and complete fusion events may occur.     

Nuclear Hexadecapole Deformation Effects on the Production of Super-Heavy Elements

We investigate the effects of the nuclear hexadecapole deformations on the interaction potentials between nuclei, the driving potentials and the fusion probabilities for some cold fusion reactions leading to super-heavy elements. It is found that nuclear hexadecapole deformations change significantly the structure of the driving potentials and the fusion probabilities for some reaction channels.     

Use of generalized exponential function to build three-dimensional reactive surfaces

In this work, we introduce a new analytical form based on the q-exponential function to build three-dimensional reactive surfaces. The quality of this new function is tested by fitting the ab initio potential energy surface (PES) to the ground state Na+HF reaction. The thermal rate constant and reactive probabilities were determined considering this new PES. The obtained properties agree with those found for other PES available in literature.     

人为扰动的模型势函数及其动力学特征

目前,结合高精度从头算方法和全维量子动力学计算,对四原子气相反应,理论计算可以获得与实验结果完全一致的结果。一般情况下,一个精确的量子动力学模拟需要一个精确的势能面,但是在实际的计算当中,势能面的拟合误差是不可避免的。在本文中,我们考察了在模型势能面外加各种扰动时的动力学反应行为,在2维的势能面上进行了量子动力学计算。反应速率常数对近反应能垒区域或最小能量反应路径上的干预是较为敏感的,但是在势能面上的其它地方加入的外加干扰对反应速率影响不大。本文给出一个比较重要的和比较简单的结论,在量子动力学模拟中,在精确的势能面上增加相关的扰动,会帮助我们更深入地理解给定类型的反应,对于一个特定体系,其精确势能面上可以作为一个模型体系研究。     

势垒高度对Cl+H2(D2)反应的影响

使用三维含时波包方法在两个势能面上研究了Cl+H2(D2)反应．所使用的两个势能面都是从CW(Capecchi和Wener)势能面得到的，第一个是CW势能面的基态面加自旋轨道耦合修正，第二个是CW势能面的基态面没有自旋轨道耦合修正．在这两个势能面上得到了碰撞能从0.1到1.4 eV的积分截面以及反应几率．对于Cl与D2反应，考虑自旋轨道耦合后由于势垒高度的增加反应截面向高能处有一个平移，但Cl与H2反应在低能处的反应活性反而增大了，原因是虽然自旋轨道耦合效应增加了势垒高度，同时减小了势垒宽度，隧道效应更加明显，而隧道效应在低能处起着比较重要的作用，所以反应活性比较大．当碰撞能大于0.7 eV时，没有考虑自旋轨道耦合时势垒高度较低，因而反应活性较大．     

聚变反应时间历程的双峰结构测量

利用新研制的聚变反应速率测量系统,在神光Ⅲ原型装置上测量了间接驱动时充DT气体的玻璃球壳内爆靶丸的聚变反应速率的时间历程,获得了DT中子产额约为1010时的聚变反应速率随时间的变化过程,发现了聚变中子发射在时间上的双峰结构。利用辐射流体程序对聚变中子在时间上的双峰结构进行了数值模拟,发现双峰结构分别由冲击压缩过程和惯性压缩过程产生,靶丸壳层厚度不同时产生的聚变中子发射双峰强度比变化可能是由靶丸的初始表面调制度不同所致。通过理论模拟与实验结果的对比,验证了中子聚变反应历程的双峰结构。     

A new global potential energy surface of the ground state of SiH2+ (X2A1) system and dynamics calculations of the Si+ + H2 (v0 = 2, j0 = 0) → SiH+ + H reaction

A global potential energy surface (PES) of the ground state of SiH$_{2}^{+}$ system is built by using neural network method based on 18223 ab initio points. The topographic properties of PES are presented and compared with previous theoretical and experimental studies. The results indicate that the spectroscopic parameters obtained from the new PES are in good agreement with the experimental data. In order to further verify the validity of the new PES, a test dynamics calculation of the Si$^{+} +$ H$_{2}$ ($v_0 = 2, j_{0} = 0$) $\to $ H $+$ SiH$^{+}$ reaction has been carried out by using the time-dependent wave packet method. The integral cross sections and rate constants are computed for the title reaction. The reasonable dynamical behavior indicates that the newly constructed PES is suitable for relevant dynamics investigations.     

Hydrophilic modification of polyethersulfone porous membranes via a thermal-induced surface crosslinking approach

A thermal-induced surface crosslinking process was employed to perform a hydrophilic surface modification of PES porous membranes. Difunctional poly(ethylene glycol) diacrylate (PEGDA) was used as the main crosslinking modifier. The addition of trifunctional trimethylolpropane trimethylacrylate (TMPTMA) into the reaction solutions accelerated the crosslinking progress of PEGDA on PES membranes. The membrane surface morphology and chemical composition were characterized by scanning electron microscopy (SEM) and FTIR-ATR spectroscopy. The mass gains (MG) of the modified membranes could be conveniently modulated by varying the PEGDA concentration and crosslinking time. The measurements of water contact angle showed that the hydrophilicity of PES membranes was remarkably enhanced by the coating of crosslinked PEGDA layer. When a moderate mass gain of about 150 μg/cm² was reached, both the permeability and anti-fouling ability of PES membranes could be significantly improved. Excessive mass gain not only contributed little to the anti-fouling ability, but also brought a deteriorated permeability to PES membranes.     

过渡金属离子Pt+和甲烷气相反应的势能面研究

采用密度泛函理论（DFT）中的B3LYP方法研究了二重态和四重态Pt+与甲烷反应的机理。通过几何构型优化和频率计算,分别获得三个过渡态,并利用内禀反应坐标（IRC）计算进行了验证。在更高的基组水平上计算了单点能,并详细讨论了二重态和四重态的势能面。结果表明在二重态势能面上的反应具有比较低的能垒,是一个放热反应,所以该反应更易于在二重态上进行。氧化加成生成中间体HPt(CH3)+的步骤需要克服一个小小的能垒。