A new anisotropic potential is fitted to ab initio data. The close-coupling approach is utilized to calculate state-tostate rotational excitation partial wave cross sections for elastic and inelastic collisions of He ...A new anisotropic potential is fitted to ab initio data. The close-coupling approach is utilized to calculate state-tostate rotational excitation partial wave cross sections for elastic and inelastic collisions of He atom with HBr molecule based on the fitted potential. The calculation is performed separately at the incident energies： 75, 100 and 200 meV.The tendency of the elastic and inelastic rotational excitation partial wave cross sections varying with total angular quantum number J is obtained.展开更多
An interaction potential of the Ne-HC1 van der Waals complex is obtained by utilizing the Huxley analytic potential function to fit the accurate interaction energy data, which have been computed at the coupled cluster...An interaction potential of the Ne-HC1 van der Waals complex is obtained by utilizing the Huxley analytic potential function to fit the accurate interaction energy data, which have been computed at the coupled cluster singles and doubles including connected triple excitations level and with the augmented correlation consistent polarized valence quintuple zeta basis set extended with a set of 3s3p2dlflg mid-bond functions [CCSD （T）/aug-cc-pV5Z-33211]. The close coupling calculation of state-to-state partial cross sections for collision of Ne with HC1 is first performed by employing the fitted interaction potential. This calculation is performed at the incident energies： 40, 60, 75 and 100 meV, separately. The effects of the long-range attractive and the short-range anisotropic interactions on the inelastic state-to-state partial cross sections are discussed in detail. Two maxima are present in the rotationally inelastic partial cross sections and they originate from different mechanisms.展开更多
Close-coupling equation and anisotropic potential developed in our previous research are applied to HE-SHe （4He, 6He, 8He,10He） collision system, and partial cross sections （PCSs） at the incident energy of 40 me V...Close-coupling equation and anisotropic potential developed in our previous research are applied to HE-SHe （4He, 6He, 8He,10He） collision system, and partial cross sections （PCSs） at the incident energy of 40 me V are calculated. By analyzing the differences of these PCSs, change rules of PCSs with the increase of partial wave number, and with the change of the mass of isotope substitution helium atom are obtained. The results show that excitation PCSs converge faster than elastic PCSs for collision energy and each of systems considered here. Also excitation PCSs converge more rapidly for high-excited states. Tail effect is present only in elastic scattering and low-excited states but not in high- excited states. With the increase of the mass of isotope substitution helium atom, converging speed of elastic, total inelastic, and state-to-state excitation PCS slows down, and the maxima of these PCSs undergoes a regular change.展开更多
This paper reports that an exact quantum close coupling calculation is carried out for rotational excitation in Ne HF collisions on the available anisotropic potential. Partial cross sections are obtained separately a...This paper reports that an exact quantum close coupling calculation is carried out for rotational excitation in Ne HF collisions on the available anisotropic potential. Partial cross sections are obtained separately at the incident energies of 48.35, 75, 120 and 150meV. The reliability of the results is demonstrated by comparison with previously published theoretical findings. Based on the calculations, the effect of the potential energy surface on the excitation partial cross sections is discussed in detail.展开更多
In this paper we use the Green function method to solve the problem of steady one dimensional flow of an incompressible viscous, electrically conducting fluid through a pipe with partial circular ring cross sec- tion ...In this paper we use the Green function method to solve the problem of steady one dimensional flow of an incompressible viscous, electrically conducting fluid through a pipe with partial circular ring cross sec- tion and one with annular cross section, in the presence of an applied transverse uniform magnetic field, We ob- tain analytic solutions and carry out some numerical calculations of the velocity distribution and induced magnet- ic field.展开更多
The dissociative ionization of CO2 induced by 5 keV electrons in two-body and three-body dissociative channels of CO2＋2 and CO3＋2 is identified by the ion-ion coincidence- method using a momentum imaging spectromete...The dissociative ionization of CO2 induced by 5 keV electrons in two-body and three-body dissociative channels of CO2＋2 and CO3＋2 is identified by the ion-ion coincidence- method using a momentum imaging spectrometer. The partial ionization cross sections （PICSs） of different ionic fragments are measured and the results generally agree with the calculations made by a semi-empirical approach. Furthermore, the PICSs of the dissociative channels are also obtained by carefully considering the detection efficiency of the micro-channel plates and the total transmission efficiency of the time of flight system.展开更多
We investigate the differential cross sections （DCS） of elastic electron scattering from CH4, CF4 and SF6 at six impact energies in a range of 100 700eV by employing the independent atom model （IAM） together with ...We investigate the differential cross sections （DCS） of elastic electron scattering from CH4, CF4 and SF6 at six impact energies in a range of 100 700eV by employing the independent atom model （IAM） together with the relativistic partial waves. The atom is present in an optical potential which is complex, spherically symmetric, and energy dependent. The optical potential of the atom is the sum of the direct static, dynamic polarization, local exchange and modified absorption potentials. The results obtained by using a modified absorption potential show significant improvements on the unmodified absorption potential results. The present results are generally in good agreement with experimental data available. In addition, the present results indicate that the structure of molecule manifests the observable effects on electron- molecule scattering.展开更多
The values of direct double- to-single ionization ratio R of helium atoms induced by C^q＋, O^q＋ （q = 1 -4） ions at incident energies from 0.2 to 8.5MeV are measured. Based on the existing model （Shao J X, Chen X ...The values of direct double- to-single ionization ratio R of helium atoms induced by C^q＋, O^q＋ （q = 1 -4） ions at incident energies from 0.2 to 8.5MeV are measured. Based on the existing model （Shao J X, Chen X M and Ding B W 2007 Phys. Rev. A 75 012701） the effective charge of the projectile is introduced to theoretically estimate the value of R for the partially stripped ions impacting on helium atoms. The results calculated from our ＂effective charge＂ model are in good agreement with the experimental data, and the dependence of the effective charge on the ionization energy of the projectile is also discussed qualitatively.展开更多
本文对最高能量为500 A MeV的^(40)Ar与铜靶作用弹核碎裂电荷变化总截面及碎片产生分截面进行了实验研究,并与相近能区^(40)Ar诱发铜靶核碎裂的实验结果及理论模型计算结果进行了比较.结果表明:电荷变化总截面与相近能区实验结果一致,也...本文对最高能量为500 A MeV的^(40)Ar与铜靶作用弹核碎裂电荷变化总截面及碎片产生分截面进行了实验研究,并与相近能区^(40)Ar诱发铜靶核碎裂的实验结果及理论模型计算结果进行了比较.结果表明:电荷变化总截面与相近能区实验结果一致,也与Bradt-Peters及Nilsen半经验公式预言一致;NUCFRG2和PHITS模型预言低于实验结果.弹核碎片产生分截面在所研究的能区范围与束流能量没有明显依赖关系,EPAX3及FRACS半经验参数化公式可以较好地再现实验结果.展开更多
An analytic expression of the potential energy surface(PES) of the ground state of the Ne-HF complex is obtained by utilizing nonlinear least square method to fit the intermolecular interaction energies [Zhang Y. Guiz...An analytic expression of the potential energy surface(PES) of the ground state of the Ne-HF complex is obtained by utilizing nonlinear least square method to fit the intermolecular interaction energies [Zhang Y. Guizhou Science,2003,21(3):9-13(in Chinese)],which have been computed using the augmented correlation-consistent polarized quadruple zeta basis set aug-cc-pVQZ at the theoretical level of CCSD(T). On the basis of the PES,the partial cross sections(PCSs) at the incident energies of 60,75,100 and 150 meV for collisions between Ne atoms and HF molecules are calculated using the quantum close coupling approach. The effects of the long-range attractive and the short-range anisotropic interactions on the inelastic PCSs are discussed in detail. The results show:(1) The long-range attractive well of the EPS makes the significant contribution to the lower excitation PCSs,especially the tail maximum for j = 0→j′ = 1 transitions,whereas no contribution is to the j′≥3 inelastic transitions.(2) The short-range(the repulsive and attractive) interaction makes the significant contri-bution to the lower excitation PCSs,especially the main peak for j = 0→j′ = 1,2. As for the transitions of j′≥3,the short-range interaction plays a key role in the inelastic excitation.(3) Although the positions of the maximums and minimums of the inelastic PCSs are different at the collision energies,they correspond to almost the same impact parameter.展开更多
基金Project supported by the National Natural Science Foundation of China （Grant Nos 10574096,10676025） and the Natural Science Foundation of Education Bureau of Anhui Province, China.
文摘A new anisotropic potential is fitted to ab initio data. The close-coupling approach is utilized to calculate state-tostate rotational excitation partial wave cross sections for elastic and inelastic collisions of He atom with HBr molecule based on the fitted potential. The calculation is performed separately at the incident energies： 75, 100 and 200 meV.The tendency of the elastic and inelastic rotational excitation partial wave cross sections varying with total angular quantum number J is obtained.
基金Project supported by the National Natural Science Foundation of China （Grant Nos 10676025 and 10574096）, the Discipline Foundation of Anqing Teachers College of China （Grant No 044-k06016000007） and the Anhui Provincial Natural Science Foundation of China （Grant No 20050610010）.
文摘An interaction potential of the Ne-HC1 van der Waals complex is obtained by utilizing the Huxley analytic potential function to fit the accurate interaction energy data, which have been computed at the coupled cluster singles and doubles including connected triple excitations level and with the augmented correlation consistent polarized valence quintuple zeta basis set extended with a set of 3s3p2dlflg mid-bond functions [CCSD （T）/aug-cc-pV5Z-33211]. The close coupling calculation of state-to-state partial cross sections for collision of Ne with HC1 is first performed by employing the fitted interaction potential. This calculation is performed at the incident energies： 40, 60, 75 and 100 meV, separately. The effects of the long-range attractive and the short-range anisotropic interactions on the inelastic state-to-state partial cross sections are discussed in detail. Two maxima are present in the rotationally inelastic partial cross sections and they originate from different mechanisms.
基金Supported by the National Natural Science Foundation of China under Grant Nos.10676025 and 10974139
文摘Close-coupling equation and anisotropic potential developed in our previous research are applied to HE-SHe （4He, 6He, 8He,10He） collision system, and partial cross sections （PCSs） at the incident energy of 40 me V are calculated. By analyzing the differences of these PCSs, change rules of PCSs with the increase of partial wave number, and with the change of the mass of isotope substitution helium atom are obtained. The results show that excitation PCSs converge faster than elastic PCSs for collision energy and each of systems considered here. Also excitation PCSs converge more rapidly for high-excited states. Tail effect is present only in elastic scattering and low-excited states but not in high- excited states. With the increase of the mass of isotope substitution helium atom, converging speed of elastic, total inelastic, and state-to-state excitation PCS slows down, and the maxima of these PCSs undergoes a regular change.
基金Project supported by the Natural Science Foundation of the Anhui Education Bureau of Chinathe National Natural Science Foundation of China (Grant No 10676025)
文摘This paper reports that an exact quantum close coupling calculation is carried out for rotational excitation in Ne HF collisions on the available anisotropic potential. Partial cross sections are obtained separately at the incident energies of 48.35, 75, 120 and 150meV. The reliability of the results is demonstrated by comparison with previously published theoretical findings. Based on the calculations, the effect of the potential energy surface on the excitation partial cross sections is discussed in detail.
文摘In this paper we use the Green function method to solve the problem of steady one dimensional flow of an incompressible viscous, electrically conducting fluid through a pipe with partial circular ring cross sec- tion and one with annular cross section, in the presence of an applied transverse uniform magnetic field, We ob- tain analytic solutions and carry out some numerical calculations of the velocity distribution and induced magnet- ic field.
基金supported by the National Basic Research Program of China(Grant No.2010CB923301)the National Natural Science Foundation of China(Grant Nos.11327404,10979007,and 10734040)the Fundamental Research Funds for the Central Universities,China
文摘The dissociative ionization of CO2 induced by 5 keV electrons in two-body and three-body dissociative channels of CO2＋2 and CO3＋2 is identified by the ion-ion coincidence- method using a momentum imaging spectrometer. The partial ionization cross sections （PICSs） of different ionic fragments are measured and the results generally agree with the calculations made by a semi-empirical approach. Furthermore, the PICSs of the dissociative channels are also obtained by carefully considering the detection efficiency of the micro-channel plates and the total transmission efficiency of the time of flight system.
基金Project supported by the Shanghai Development Foundation from Science and Technology, China （Grant Nos 06JC14082 and 06QA14062）, the National Natural Science Foundation of China （Grant No 10535010）, and the Knowledge Innovation Project of Chinese Academy of Sciences （Grant No KJXC3-SYW-N2）.
文摘We investigate the differential cross sections （DCS） of elastic electron scattering from CH4, CF4 and SF6 at six impact energies in a range of 100 700eV by employing the independent atom model （IAM） together with the relativistic partial waves. The atom is present in an optical potential which is complex, spherically symmetric, and energy dependent. The optical potential of the atom is the sum of the direct static, dynamic polarization, local exchange and modified absorption potentials. The results obtained by using a modified absorption potential show significant improvements on the unmodified absorption potential results. The present results are generally in good agreement with experimental data available. In addition, the present results indicate that the structure of molecule manifests the observable effects on electron- molecule scattering.
基金Project supported by the National Natural Science Foundation of China (Grant No 10775063)
文摘The values of direct double- to-single ionization ratio R of helium atoms induced by C^q＋, O^q＋ （q = 1 -4） ions at incident energies from 0.2 to 8.5MeV are measured. Based on the existing model （Shao J X, Chen X M and Ding B W 2007 Phys. Rev. A 75 012701） the effective charge of the projectile is introduced to theoretically estimate the value of R for the partially stripped ions impacting on helium atoms. The results calculated from our ＂effective charge＂ model are in good agreement with the experimental data, and the dependence of the effective charge on the ionization energy of the projectile is also discussed qualitatively.
文摘本文对最高能量为500 A MeV的^(40)Ar与铜靶作用弹核碎裂电荷变化总截面及碎片产生分截面进行了实验研究,并与相近能区^(40)Ar诱发铜靶核碎裂的实验结果及理论模型计算结果进行了比较.结果表明:电荷变化总截面与相近能区实验结果一致,也与Bradt-Peters及Nilsen半经验公式预言一致;NUCFRG2和PHITS模型预言低于实验结果.弹核碎片产生分截面在所研究的能区范围与束流能量没有明显依赖关系,EPAX3及FRACS半经验参数化公式可以较好地再现实验结果.
基金Supported by the National Natural Science Foundation of China (Grant Nos. 10676025 and 10574096)
文摘An analytic expression of the potential energy surface(PES) of the ground state of the Ne-HF complex is obtained by utilizing nonlinear least square method to fit the intermolecular interaction energies [Zhang Y. Guizhou Science,2003,21(3):9-13(in Chinese)],which have been computed using the augmented correlation-consistent polarized quadruple zeta basis set aug-cc-pVQZ at the theoretical level of CCSD(T). On the basis of the PES,the partial cross sections(PCSs) at the incident energies of 60,75,100 and 150 meV for collisions between Ne atoms and HF molecules are calculated using the quantum close coupling approach. The effects of the long-range attractive and the short-range anisotropic interactions on the inelastic PCSs are discussed in detail. The results show:(1) The long-range attractive well of the EPS makes the significant contribution to the lower excitation PCSs,especially the tail maximum for j = 0→j′ = 1 transitions,whereas no contribution is to the j′≥3 inelastic transitions.(2) The short-range(the repulsive and attractive) interaction makes the significant contri-bution to the lower excitation PCSs,especially the main peak for j = 0→j′ = 1,2. As for the transitions of j′≥3,the short-range interaction plays a key role in the inelastic excitation.(3) Although the positions of the maximums and minimums of the inelastic PCSs are different at the collision energies,they correspond to almost the same impact parameter.
