基于基尔霍夫定律,研制了一种采用双光路对比法测量中、高温物体发射率的实验装置。该装置由样品加热系统、信号检测与处理系统以及显示系统三部分组成。用该装置测量了两种标准不锈钢样品(光滑钢片和粗糙钢片)在不同温度下的发射率,并采用最小二乘法将测量数据拟合成解析函数。分析了该装置的发射率测量不确定度随温度的变化关系。结果表明,在800 K-1100 K内,光滑钢片发射率的最大不确定度为σε=4.26×10-3,由此引起的测温不确定度为σT=0.497 K,σT/T=0.0611%;粗糙钢片发射率的最大不确定度为σε=3.80×10-3,由此引起的测温不确定度为σT=0.415 K,σT/T=0.0507%。

Considering the changes of the geometric shielding effect in a molecule as the incident electron energy varing, an empirical fraction, which is dependent on the incident electron energy, is presented. Using this empirical fraction, the total cross sections (TCSs) for electrons scattering from complex polyatomic molecules C2F4 and SO2 are calculated over a wide energy range from 30 to 5000 eV together with the additivity rule model at Hartree-Fock level. In the TCS calculations, the atoms are presented by the spherical complex optical potential, which is composed of static, exchange, polarization and absorption contributions. The quantitative TCSs above 100 eV are in good agreement with those obtained by experiments and other theories. It is proved that the empirical fraction, which exhibits the TCS contributions of shielded atoms in a molecule at different energies, is reasonable.

The total (elastic plus inelastic) cross sections for positron scattering from N2 and CO2 over the incident energy range from 30 to 3000eV are calculated using the additivity rule model at Hartree-Fock level. A complex optical model potential modified by incorporating the concept of bonded atom, which takes into account the overlapping effect of electron clouds between two atoms in a molecule, is employed to calculate the total cross section of positron-molecule scattering. The calculated total cross sections are in good agreement with those reported by experiments and other theories over a wide energy range.

The accurate dissociation energy and equilibrium geometry of the b3Π state of 7LiH molecule is calculated using a symmetry-adapted-cluster configuration-interaction method in full active space. And the calculated results are 0.2580 eV and 0.1958 nm for the dissociation energy and equilibrium geometry, respectively. The whole potential energy curve for the b3Π state is also calculated over the internuclear separation range from about 0.10 to 0.54 nm. The results are fitted by the Murrell-Sorbie function. It is found that the Murrell-Sorbie function form, which is mainly used to fit the ground-state potential energy function, is well suitable for the excited triplet b3Π state. The vertical excitation energy from the ground state to the b3Π state is calculated to be 4.233 eV. Based on the analytic potential energy function, the harmonic frequency of 610.88 cm^(-1) about this state is firstly estimated. Compared with other theoretical results, this work is the most complete effort to deal with the analytic potential energy function and the harmonic frequency of this state.

Total cross sections (TCSs) of electrons scattering from triatomic molecules over the energy range from 30 to 5000 eV are investigated employing a new semi-empirical formula. The TCSs of electrons scattering from triatomic molecules SO2, NO2, and CO2 are calculated. The quantitative TCSs are in good agreement with those obtained by experiments. It is shown that the results derived from the semi-empirical formula are much closer to the measurements than other calculations.

A complex optical model potential correlated by the concept of bonded atoms, which considers the overlapping effect of electron clouds between two atoms in a molecule, is firstly employed to calculate the absolute differential cross sections, the integrated and momentum transfer cross sections for electrons scattered by O2 at intermediate and high energies by using additivity rule model at Hartree-Fock level. In the study, the complex optical model potential is composed of static, exchange, correlation polarization plus absorption contributions. The quantitative absolute differential cross sections, the integrated and momentum transfer cross sections are obtained. Compared with available experimental data, this approach presents good results. It is shown that the additivity rule model together with the complex optical model potential correlated by the concept of bonded atoms is completely suitable for the calculations of the absolute differential cross sections, the integrated and momentum transfer cross sections.

A model complex optical potential rewritten by the conception of bonded atom, which considers the overlapping effect of electron cloud, is employed to calculate the total (elastic + inelastic) cross sections with simple molecules (N_(2), O_(2), NO_(2), NO, N_(2)O) consisting of N & O atoms over an incident energy range of 100 - 1600 eV by the use of additivity rule at Roothaan-Hartree-Fock level. In the study, the complex optical potential composed of static, exchange, correlation polarization plus absorption contributions firstly uses bonded-atom conception. The qualitative results are compared with experimental data and other calculations wherever available and good agreement is obtained. The total cross sections of electronmolecule scattering above 100 eV can be successfully calculated.