Niels Bohr constructed the first version of quantum mechanics. It has been called “old quantum mechanics” with a connotation of being obsolete. It is logically consistent, however, and deserves the name of simple qu...Niels Bohr constructed the first version of quantum mechanics. It has been called “old quantum mechanics” with a connotation of being obsolete. It is logically consistent, however, and deserves the name of simple quantum mechanics (SQM). It differs only from the semiclassical approximation by assuming that the average position and average velocity of an electron can be sharply defined on closed orbits. This assumption does not contradict Heisenberg’s uncertainty relations, since the quantization rule means that the electron can be anywhere on this orbit when it allows for stationary waves. This approach was remarkably efficient for one electron in hydrogen atoms and even for the electron pair in hydrogen molecules. However, dissociation of H2 and determination of the orbit of the single electron in H2+led to problems that remained unsolved for more than 100 years. Their solution, presented here, yields more physical insight and reveals, for instance, that mutual polarization of two hydrogen atoms can yield a metastable state.展开更多
The interaction of MeV H2^+ molecular ions with thin layer graphene and graphite foils was studied by using a highresolution electrostatic analyzer.A large number of fragment protons were observed at zero degree(along...The interaction of MeV H2^+ molecular ions with thin layer graphene and graphite foils was studied by using a highresolution electrostatic analyzer.A large number of fragment protons were observed at zero degree(along the beam direction) when the H2^+ beam was passing through the monolayer graphene foil, which indicates that the electron of the H2^+ molecular ions can be stripped easily even by the monolayer graphene foil.More trailing than leading protons were found in the energy spectrum, which means significant wake effect was observed in the monolayer graphene foil.The ratio of the numbers of trailing protons over leading protons first increased with the thickness for the much thinner graphene foils, and then decreased with the thickness for the much thicker graphite foils, which indicates that the bending effect of the wake field on the trailing proton varied with the foil thickness.展开更多
A localized INDO method was used to calculate the ion [Fe_2 (CH_3) (CO) (Ph_2PCH_2PPh_2)- Cp_2]^+. Based on the analysis of the localized molecular orbitals (LMO), bond orders and contour maps, it was pointed out that...A localized INDO method was used to calculate the ion [Fe_2 (CH_3) (CO) (Ph_2PCH_2PPh_2)- Cp_2]^+. Based on the analysis of the localized molecular orbitals (LMO), bond orders and contour maps, it was pointed out that the LMO no. 20 corresponds to the coordination of C(1)-H(I) σbond to Fe(2) atom. Non occurrence of metal-metal bond between Fe(1) and Fe(2) atoms was found and the covalence of irons was numerated, which coincides with the value in ref 17.展开更多
文摘Niels Bohr constructed the first version of quantum mechanics. It has been called “old quantum mechanics” with a connotation of being obsolete. It is logically consistent, however, and deserves the name of simple quantum mechanics (SQM). It differs only from the semiclassical approximation by assuming that the average position and average velocity of an electron can be sharply defined on closed orbits. This assumption does not contradict Heisenberg’s uncertainty relations, since the quantization rule means that the electron can be anywhere on this orbit when it allows for stationary waves. This approach was remarkably efficient for one electron in hydrogen atoms and even for the electron pair in hydrogen molecules. However, dissociation of H2 and determination of the orbit of the single electron in H2+led to problems that remained unsolved for more than 100 years. Their solution, presented here, yields more physical insight and reveals, for instance, that mutual polarization of two hydrogen atoms can yield a metastable state.
基金Project supported by the National Natural Science Foundation of China(Grant No.11575121)the National Magnetic Confinement Fusion Program of China(Grant No.2014GB125004)
文摘The interaction of MeV H2^+ molecular ions with thin layer graphene and graphite foils was studied by using a highresolution electrostatic analyzer.A large number of fragment protons were observed at zero degree(along the beam direction) when the H2^+ beam was passing through the monolayer graphene foil, which indicates that the electron of the H2^+ molecular ions can be stripped easily even by the monolayer graphene foil.More trailing than leading protons were found in the energy spectrum, which means significant wake effect was observed in the monolayer graphene foil.The ratio of the numbers of trailing protons over leading protons first increased with the thickness for the much thinner graphene foils, and then decreased with the thickness for the much thicker graphite foils, which indicates that the bending effect of the wake field on the trailing proton varied with the foil thickness.
文摘A localized INDO method was used to calculate the ion [Fe_2 (CH_3) (CO) (Ph_2PCH_2PPh_2)- Cp_2]^+. Based on the analysis of the localized molecular orbitals (LMO), bond orders and contour maps, it was pointed out that the LMO no. 20 corresponds to the coordination of C(1)-H(I) σbond to Fe(2) atom. Non occurrence of metal-metal bond between Fe(1) and Fe(2) atoms was found and the covalence of irons was numerated, which coincides with the value in ref 17.
