The autoionization branching ratios from Eu 4f76p1/26 d [J] autoionizing states to its 4f76s+(9So), 4f76s+(7So), and4f75d+(9Do) final ionic states are investigated with the combination of the three-step laser excitati...The autoionization branching ratios from Eu 4f76p1/26 d [J] autoionizing states to its 4f76s+(9So), 4f76s+(7So), and4f75d+(9Do) final ionic states are investigated with the combination of the three-step laser excitation and the velocity-map imaging technique. These different autoionizing states are excited via 4f76s6d8 DJ [J = 5/2, 7/2, and 9/2] intermediate states, respectively. The experimental photoelectron images are obtained, from which energy distributions of ejected electrons are achieved with the mathematical transformation. Furthermore, the energy dependence of the branching ratio is investigated within the autoionization resonance, by which population inversion is observed as an important characteristic.The J-dependence is also studied systematically. The validity of the well-known isolated core excitation technique used for obtaining the autoionization spectrum is also studied.展开更多
Ab initio CCSD(T)/CBS//B3LYP/6-311G(d,p)calculations of the potential energy surface for possible dissociation channels of HOC2H3F,as well as Rice-Ramsperger-Kassel-Marcus(RRKM)calculations of rate constants,were carr...Ab initio CCSD(T)/CBS//B3LYP/6-311G(d,p)calculations of the potential energy surface for possible dissociation channels of HOC2H3F,as well as Rice-Ramsperger-Kassel-Marcus(RRKM)calculations of rate constants,were carried out,in order to predict statistical product branching ratios in dissociation of HOC2H3F at various internal energies.The most favorable reaction pathway leading to the major CH2CHO+HF products is as the following:OH+C2H3F→i2→TS14→i6→TS9→i3→TS3→CH2CHO+HF,where the rate-determining step is HF elimination from the CO bridging position via TS11,lying above the reactants by 3.8 kcal/mol.The CH2O+CH2F products can be formed by F atom migration from Cαto Cβposition via TS14,then H migration from O to Cαposition via TS16,and C-C breaking to form the products via TS5,which is 1.8 kcal/mol lower in energy than the reactants,and 4.0 kcal/mol lower than TS11.展开更多
The photoabsorption and photodissociation of carbon monoxide(CO)in the vacuum ultraviolet(VUV)region is one of the most important photochemical processes in the interstellar medium,thus it has attracted numerous exper...The photoabsorption and photodissociation of carbon monoxide(CO)in the vacuum ultraviolet(VUV)region is one of the most important photochemical processes in the interstellar medium,thus it has attracted numerous experimental and theoretical studies.Here,we employed the two-color VUV-VUV laser pump-probe time-slice velocity-map ion imaging method to measure the relative branching ratios[C(3P0)+O(1D)]/{[C(3P0)+O(3P)]+[C(3P0)+O(1D)]}and[C(3P2)+O(1D)]/{[C(3P2)+O(3P)]+[C(3P2)+O(1D)]}in the VUV photoexcitation energy range of 108000-113200 cm^−1.Here,one tunable VUV laser beam is used to excite CO to speci c rovibronic states,and a second independently tunable VUV laser beam is used to state-selectively ionize C(3P0)and C(3P2)for detection.State-selective photoionization through the 1VUV+1UV/visible resonance-enhanced multiphoton ionization scheme has greatly enhanced the detection sensitivity,which makes many new weak absorption bands observable in the current study.The branching ratio measurement shows that the spin-forbidden channels C(3P0)+O(1D)and C(3P2)+O(1D)only open at several discrete narrow energy windows.This might be caused by certain accidental resonanceenhanced spin-orbit interactions between the directly excited Rydberg states and valence states of triplet type which nally dissociate into the spin-forbidden channels.展开更多
The potential energy surface of O(^1D)+C2H5Cl reaction was studied using QCISD(T)/6- 311++G(d,p)//MP2/6-31G(d,p) method. The calculations reveal an insertion-elimination mechanism. The insertion reaction o...The potential energy surface of O(^1D)+C2H5Cl reaction was studied using QCISD(T)/6- 311++G(d,p)//MP2/6-31G(d,p) method. The calculations reveal an insertion-elimination mechanism. The insertion reaction of O(^1D) and C2H5Cl produces two energy-rich intermediates, IM1 and IM2, which subsequently decompose into various products. The calculations of the branching ratios of various products formed through the two intermediates were carried out using RRKM (Rice-Ramsperger-Kassel-Marcus) theory at the collision energies of 0, 20.9, 41.8, 62.7, 83.6, 104.5, and 125.4 kJ/mol. HCl is the main decomposition product for IM1; CH2OH is the main decomposition product for IM2. Since IM1 is more stable than IM2, HCl is probably the main product of the O(^1D)+C2H5Cl reaction.展开更多
We present a systematic calculation on the α-decay branching ratios to excited-states of an even-even α-decay chain ^242Cm → ^238Pu → ^234U → ^230Th → ^226Rn by the improved barrier penetration approach. The c...We present a systematic calculation on the α-decay branching ratios to excited-states of an even-even α-decay chain ^242Cm → ^238Pu → ^234U → ^230Th → ^226Rn by the improved barrier penetration approach. The changes of the parities between the parent nuclei and the daughter nuclei are properly taken into account. The theoretical values are compared with the available experimental data and the deviation between them is within a factor of 5 in most cases.展开更多
Photodissociation of jet-cooled HOD via the C state around 124 nm has been studied using the H(D)-atom Rydberg tagging time-of-flight technique. Rotational state resolved action spectrum and the product translationa...Photodissociation of jet-cooled HOD via the C state around 124 nm has been studied using the H(D)-atom Rydberg tagging time-of-flight technique. Rotational state resolved action spectrum and the product translational energy distribution spectra have been recorded for both D+OH and H+OD dissociation channels. Product channel OH/OD branching ratios for the individual C-X rotational transition have been determined. A comparison is also given with the B-X and A-X transitions. In addition, the dissociation energy of the OD bond in HOD has been determined accurately to be 41751.3±5 cm-1.展开更多
The branching ratios of ions and the angular distributions of electrons ejected from the Eu 4f^76p_(1/2)nd auto-ionizing states are investigated with the velocity-map-imaging technique.To populate the above auto-ion...The branching ratios of ions and the angular distributions of electrons ejected from the Eu 4f^76p_(1/2)nd auto-ionizing states are investigated with the velocity-map-imaging technique.To populate the above auto-ionizing states,the relevant bound Rydberg states have to be detected first.Two new bound Rydberg states are identified in the region between41150 cm^(-1)and 44580 cm^(-1),from which auto-ionization spectra of the Eu 4f^76p_(1/2)nd states are observed with isolated core excitation method.With all preparations above,the branching ratios from the above auto-ionizing states to different final ionic states and the angular distributions of electrons ejected from these processes are measured systematically.Energy dependence of branching ratios and anisotropy parameters within the auto-ionization spectra are carefully analyzed,followed by a qualitative interpretation.展开更多
The hydrogen abstraction reaction F+CH3OH has two possible reaction pathways: HF+CH3O and HF+CH2OH. Despite the absence of intrinsic barriers for both channels, the former has a branching ratio comparable to the latte...The hydrogen abstraction reaction F+CH3OH has two possible reaction pathways: HF+CH3O and HF+CH2OH. Despite the absence of intrinsic barriers for both channels, the former has a branching ratio comparable to the latter, which is far from the statistical limit of 0.25 (one out of four available H atoms). Furthermore, the measured branching ratio of the two abstraction channels spans a large range and is not quantitatively reproduced by previous theoretical predictions based on the transition-state theory with the stationary point information calculated at the levels of MФller-Plesset perturbation theory and G2. This work reports a theoretical investigation on the kinetics and the associated branching ratio of the two competing channels of the title reaction using a quasi-classical trajectory approach on an accurate full-dimensional potential energy surface (PES) fitted by the permutation invariant polynomial-neural network approach to ca. 1.21x10^5 points calculated at the explicitly correlated (F12a) version of coupled cluster singles doubles and perturbative triples (CCSD(T)) level with the aug-cc-pVDZ basis set. The calculated room temperature rate coeffcient and branching ratio of the HF+CH3O channel are in good agreement with the available experimental data. Furthermore, our theory predicts that rate coeffcients have a slightly negative temperature dependence, consistent with barrierless nature of the reaction.展开更多
A detailed investigation of different decay modes,namely alpha decay,beta decay,cluster decay including heavy particle emission(Z_(c)>28),and spontaneous fission,was carried out,leading to the identification of new...A detailed investigation of different decay modes,namely alpha decay,beta decay,cluster decay including heavy particle emission(Z_(c)>28),and spontaneous fission,was carried out,leading to the identification of new cluster and beta-plus emitters in superheavy nucle with 104≤Z≤126.For the first time,we identified around20 beta-plus emitters in superheavy nuclei.Heavy-particle radioactivity was observed in superheavy elements of atomic number in the range 116≤Z≤126.^(292-293)Og were identified as ^(86)Kr emitters,and ^(298)122 and ^(300)122 were identified as ^(94)Zr emitters,whereas heavy-particle radioactivity from ^(91)Y was also observed in ^(299)123.Furthermore,the nuclei ^(300)124 and ^(306)126 exhibit ^(96)Mo radioactivity.The reported regions of beta-plus and heavyparticle radioactivity for superheavy nuclei are stronger than those for alpha decay.The identified decay modes for superheavy nuclei are presented in a chart.This study is intended to serve as a reference for identifying possible decay modes in the superheavy region.展开更多
The quasi-classical trajectory calculation for the reaction O(^1D)+HD is carried out based on the Dobbyn and Knowles potential energy surface. In this work, the reaction cross section and product branching ratio ar...The quasi-classical trajectory calculation for the reaction O(^1D)+HD is carried out based on the Dobbyn and Knowles potential energy surface. In this work, the reaction cross section and product branching ratio are obtained. The product branching ratio OD/OH was discussed. The calculated results show that the cross-section decreases thoroughly with the increasing of the collision energy from 4.6 kJ/mol to 46.0 kJ/mol. The average branching ratio decrease with the increase of rotational quantum number of reactant HD.展开更多
In this article, we calculate the branching ratios of B→K0^* (1430)K decays by employing the pertur-bative QCD (pQCD) approach at leading order. We perform the evaluations in the two scenarios for the scalar mes...In this article, we calculate the branching ratios of B→K0^* (1430)K decays by employing the pertur-bative QCD (pQCD) approach at leading order. We perform the evaluations in the two scenarios for the scalar meson spectrum. We find that (i) The leading order pQCD predictions for the branching ratio Br(B^+→K^+K0^*(1430)^0)are in good agreement with the experimental upper limit in both scenarios, while the pQCD predictions for other considered B→K0^*(1430)K decay modes are also presented and will be tested by the LHC experiments; (ii) The annihilation contributions play an important role in these considered decays, for B^0→K0^*(1430)^±K^± decays,for example,which are found to be (1-4)×10^-6.展开更多
By employing the perturbative QCD (pQCD) factorization approach, we calculate some important next- to-leading-order (NLO) contributions to the two-body charmless hadronic decays B^+ →ρ^+η(') and B^0 → ρ^...By employing the perturbative QCD (pQCD) factorization approach, we calculate some important next- to-leading-order (NLO) contributions to the two-body charmless hadronic decays B^+ →ρ^+η(') and B^0 → ρ^0(ω, φ)η('), induced by the vertex QCD corrections, the quark-loops as well as the chromo-magnetic penguins. From the numerical results and phenomenological analysis we find that (a) for B^± → ρ^±η(') (B^0 → ρ^0(ω, φ)η(')decays, the partial NLO contributions to branching ratios are small (large) in magnitude; and (b) the pQCD predictions for ACP^dir(B^± → ρ^±η(')) are consistent with the data, while the predicted .ACP(B^0 → ρ^0(ω)η(')) are generally large in magnitude and could be tested by the forthcoming LHCb experiments.展开更多
In the two-quark model supposition for the meson ao(1450), which can be viewed as either the first excited state (scenario I) or the lowest lying state (scenario II), the branching ratios and the direct CP-viola...In the two-quark model supposition for the meson ao(1450), which can be viewed as either the first excited state (scenario I) or the lowest lying state (scenario II), the branching ratios and the direct CP-violating asymmetries for decays B→a0(1450)ρ(ω) are studied by employing the perturbative QCD factorization approach. We find the following results: (a) For the decays B- B→a0(1450)ρ- andB→a0^+(1450)ρ^-, their branching ratios have large difference between two scenarios. Although their branching ratios are larger than other considered decay modes, their direct CP-violating asymmetries in both scenarios are small. (b) For the decays B-→a0^-(1450)ρ0 and B0→ a0(1450)ρ+, a0^0(1450)ρ0, a00 (1450)w, their branching ratios are dose to each other between two scenarios, respectively. (c) Comparing with the decays a0^0(1450)ρ0,π0ρ0 π0π0, the decay B-→a0^-(1450)ρ0 receives a larger branching ratio in each scenario, which is sensitive to the variation of the Cabibbo-Kobayashi-Maskawa angle α.展开更多
Using the form factors from light-cone sum rules, we study the branching ratios and forward-backward asymmetries (FBAs) of the exclusive decays Bu^+→π^+e^+e^- and Bu^+ →ρ^+e^+e^- (e= e,μ) in the standar...Using the form factors from light-cone sum rules, we study the branching ratios and forward-backward asymmetries (FBAs) of the exclusive decays Bu^+→π^+e^+e^- and Bu^+ →ρ^+e^+e^- (e= e,μ) in the standard model (SM) and the top quark two-Higgs-doublet model (T2HDM). From the numerical results, we find that the new physics contributions cannot provide very large enhancement to the branching ratios and the theoretical predictions are in good agreement with the SM ones. The T2HDM effects on FBAs of these decays are small. Precision measurements of the dilepton invariant mass distributions, especially in the lower dilepton mass region, and the FBAs in the decays Bu^+ → π^+ (ρ^+ )e^+ e^- will greatly help in discriminating among the SM and the new physics models.展开更多
The product branching ratio between different products in multichannel reactions is as important as the overall rate of reaction,both in terms of practical applications(e.g.models of combustion or atmosphere chemistry...The product branching ratio between different products in multichannel reactions is as important as the overall rate of reaction,both in terms of practical applications(e.g.models of combustion or atmosphere chemistry)in understanding the fundamental mechanisms of such chemical reactions.A global ground state potential energy surface for the dissociation reaction of deuterated alkyl halide CD_(3)CH_(2)F was computed at the CCSD(T)/CBS//B3 LYP/aug-cc-p VDZ level of theory for all species.The decomposition of CD_(3)CH_(2)F is controversial concerning C-F bond dissociation reaction and molecular(HF,DF,H_(2),D_(2),HD)elimination reaction.RiceRamsperger-Kassel-Marcus(RRKM)calculations were applied to compute the rate constants for individual reaction steps and the relative product branching ratios for the dissociation products were calculated using the steady-state approach.At the different energies studied,the RRKM method predicts that the main channel for DF or HF elimination from1,2-elimination of CD_(3)CH_(2)F is through a four-center transition state,whereas D_(2) or H_(2) elimination from 1,1-elimination of CD_(3)CH_(2)F occurs through a direct three-center elimination.At 266,248,and 193 nm photodissociation,the main product CD_(2)CH_(2)+DF branching ratios are computed to be 96.57%,91.47%,and 48.52%,respectively;however,at 157 nm photodissociation,the product branching ratio is computed to be 16.11%.Based on these transition state structures and energies,the following photodissociation mechanisms are suggested:at 266,248,193 nm,CD_(3)CH_(2)F→absorption of a photon→TS5→the formation of the major product CD_(2)CH_(2)+DF;at 157 nm,CD_(3)CH_(2)F→absorption of a photon→D/F interchange of TS1→CDH_(2)CDF→H/F interchange of TS2→CHD_(2)CHDF→the formation of the major product CHD_(2)+CHDF.展开更多
Based on the low energy effective Hamiltonian with naive factorization, we calculate the branching ratios (BRs) and CP asymmetries (CPAs) for the twenty three double charm decays B/B8 → D(*)D(*) in both the...Based on the low energy effective Hamiltonian with naive factorization, we calculate the branching ratios (BRs) and CP asymmetries (CPAs) for the twenty three double charm decays B/B8 → D(*)D(*) in both the standard (s) (s) model (SM) and the minimal supergravity (mSUGRA) model. Within the considered parameter space, we find that (a) the theoretical predictions for the BRs, CPAs and the polarization fractions in the SM and the mSUGRA model are all consistent with the currently available data within ±2σ errors; (b) For all the considered decays, the supersymmetric contributions in the mSUGRA model are very small, less than 7% numerically. It may be difficult to observe so small SUSY contributions even at LHC.展开更多
We calculate the flavor changing decay in the framework of the topcolor assisted multiscale technicolor model. We find that (a) the branching ratio of is insensitive to and , while it increases quickly as increase...We calculate the flavor changing decay in the framework of the topcolor assisted multiscale technicolor model. We find that (a) the branching ratio of is insensitive to and , while it increases quickly as increases; (b) for reasonable ranges of the parameters, the maximum of the branching ratio in this model may reach , seven orders larger compared to the one calculated in the standard model. This might provide an opportunity to detect the rare decay of the top quark in experiments.展开更多
Rare decay processes K→πvv^- and KL→π^0vv^- are considered in the framework of three-site Higgsless model. The contributions of this new physics model to these two decay processes come from the new heavy gauge bos...Rare decay processes K→πvv^- and KL→π^0vv^- are considered in the framework of three-site Higgsless model. The contributions of this new physics model to these two decay processes come from the new heavy gauge bosons and the correction terms for the couplings of the ordinary gauge bosons with fermions. Our numerical results show that the branching ratios of these two decay processes can be enhanced by 40% and 50% relative to those predicted by the standard model.展开更多
The H+CH_(3) OH reaction,which plays an important role in combustion and the interstellar medium,presents a prototypical system with multiple channels.In this work,mode specific dynamics of different product channels ...The H+CH_(3) OH reaction,which plays an important role in combustion and the interstellar medium,presents a prototypical system with multiple channels.In this work,mode specific dynamics of different product channels is investigated theoretically on a recently developed reliable potential energy surface based on a large number of data points calculated at the level of UCCSD(T)-F12 a/AVTZ.It has been demonstrated that vibrational excitations of the O-H stretching motion,the torsional motion,the C-H stretching vibrations,show different infuences on the four product channels,H_(2)+CH_(3) O,H_(2)+CH_(2)OH,H_(2) O+CH_(3),and H+CH_(3) OH.This work is helpful for understanding the mode-specific dynamics and controlling the competition for complicated reactions with multiple product channels.展开更多
By employing the QCD factorization approach for the exclusive B→Vу decays, we study the exclusive decay B→K^*у in the top-quark two-Higgs-doublet mode/(T2HDM). Within the considered parameter space, we find the...By employing the QCD factorization approach for the exclusive B→Vу decays, we study the exclusive decay B→K^*у in the top-quark two-Higgs-doublet mode/(T2HDM). Within the considered parameter space, we find the following conclusions (a) A hght charged-Higgs boson with a mass about 200 GeV is clearly excluded by the date of B→K^*у decay, and this lower limit is comparable with that from the inclusive B→X8*у decay; (b) The theoretical predictions for CP asymmetry of B→K^*у in the T2HDM is always less than 1% in size; and (c) The isospin symmetry breaking for B→K^*у decay in the SM and T2HDM considered here is around 6% in size and well consistent with the data and the general expectations.展开更多
基金supported by the National Natural Science Foundation of China(Grant No.11174218)
文摘The autoionization branching ratios from Eu 4f76p1/26 d [J] autoionizing states to its 4f76s+(9So), 4f76s+(7So), and4f75d+(9Do) final ionic states are investigated with the combination of the three-step laser excitation and the velocity-map imaging technique. These different autoionizing states are excited via 4f76s6d8 DJ [J = 5/2, 7/2, and 9/2] intermediate states, respectively. The experimental photoelectron images are obtained, from which energy distributions of ejected electrons are achieved with the mathematical transformation. Furthermore, the energy dependence of the branching ratio is investigated within the autoionization resonance, by which population inversion is observed as an important characteristic.The J-dependence is also studied systematically. The validity of the well-known isolated core excitation technique used for obtaining the autoionization spectrum is also studied.
基金supported by the National Natural Science Foundation of China (No.91641116).
文摘Ab initio CCSD(T)/CBS//B3LYP/6-311G(d,p)calculations of the potential energy surface for possible dissociation channels of HOC2H3F,as well as Rice-Ramsperger-Kassel-Marcus(RRKM)calculations of rate constants,were carried out,in order to predict statistical product branching ratios in dissociation of HOC2H3F at various internal energies.The most favorable reaction pathway leading to the major CH2CHO+HF products is as the following:OH+C2H3F→i2→TS14→i6→TS9→i3→TS3→CH2CHO+HF,where the rate-determining step is HF elimination from the CO bridging position via TS11,lying above the reactants by 3.8 kcal/mol.The CH2O+CH2F products can be formed by F atom migration from Cαto Cβposition via TS14,then H migration from O to Cαposition via TS16,and C-C breaking to form the products via TS5,which is 1.8 kcal/mol lower in energy than the reactants,and 4.0 kcal/mol lower than TS11.
基金the National Natural Science Foundation of China(No.21803072)the Program for Young Outstanding Scientists of Institute of Chemistry,Chinese Academy of Science(ICCAS),and Beijing National Laboratory for Molecular Sciences(BNLMS).+1 种基金the National Aeronautics and Space Administration Award #80NSSC18K0592 and National Science Foundation under CHE-1763319.Yu SongWilliam.M.Jackson gratefully acknowledge the support of NSF under grants CHE-1301501 and AST-1410297.
文摘The photoabsorption and photodissociation of carbon monoxide(CO)in the vacuum ultraviolet(VUV)region is one of the most important photochemical processes in the interstellar medium,thus it has attracted numerous experimental and theoretical studies.Here,we employed the two-color VUV-VUV laser pump-probe time-slice velocity-map ion imaging method to measure the relative branching ratios[C(3P0)+O(1D)]/{[C(3P0)+O(3P)]+[C(3P0)+O(1D)]}and[C(3P2)+O(1D)]/{[C(3P2)+O(3P)]+[C(3P2)+O(1D)]}in the VUV photoexcitation energy range of 108000-113200 cm^−1.Here,one tunable VUV laser beam is used to excite CO to speci c rovibronic states,and a second independently tunable VUV laser beam is used to state-selectively ionize C(3P0)and C(3P2)for detection.State-selective photoionization through the 1VUV+1UV/visible resonance-enhanced multiphoton ionization scheme has greatly enhanced the detection sensitivity,which makes many new weak absorption bands observable in the current study.The branching ratio measurement shows that the spin-forbidden channels C(3P0)+O(1D)and C(3P2)+O(1D)only open at several discrete narrow energy windows.This might be caused by certain accidental resonanceenhanced spin-orbit interactions between the directly excited Rydberg states and valence states of triplet type which nally dissociate into the spin-forbidden channels.
基金ACKNOWLEDGMENT This work was supported Science Foundation of China by the National Natural (No.50772107).
文摘The potential energy surface of O(^1D)+C2H5Cl reaction was studied using QCISD(T)/6- 311++G(d,p)//MP2/6-31G(d,p) method. The calculations reveal an insertion-elimination mechanism. The insertion reaction of O(^1D) and C2H5Cl produces two energy-rich intermediates, IM1 and IM2, which subsequently decompose into various products. The calculations of the branching ratios of various products formed through the two intermediates were carried out using RRKM (Rice-Ramsperger-Kassel-Marcus) theory at the collision energies of 0, 20.9, 41.8, 62.7, 83.6, 104.5, and 125.4 kJ/mol. HCl is the main decomposition product for IM1; CH2OH is the main decomposition product for IM2. Since IM1 is more stable than IM2, HCl is probably the main product of the O(^1D)+C2H5Cl reaction.
基金Supported by National Natural Science Foundation of China (10535010, 10805026, 10775068, 10735010)Major State Basic Research Development Program (2007CB815004)Doctoral Fund of Ministry of Education of China (20070284016)
文摘We present a systematic calculation on the α-decay branching ratios to excited-states of an even-even α-decay chain ^242Cm → ^238Pu → ^234U → ^230Th → ^226Rn by the improved barrier penetration approach. The changes of the parities between the parent nuclei and the daughter nuclei are properly taken into account. The theoretical values are compared with the available experimental data and the deviation between them is within a factor of 5 in most cases.
基金ACKNOWLEDGMENTS This work was supported by the Chinese Academy of Sciences, the Ministry of Science and Technology, and the National Natural Science Foundation of China.
文摘Photodissociation of jet-cooled HOD via the C state around 124 nm has been studied using the H(D)-atom Rydberg tagging time-of-flight technique. Rotational state resolved action spectrum and the product translational energy distribution spectra have been recorded for both D+OH and H+OD dissociation channels. Product channel OH/OD branching ratios for the individual C-X rotational transition have been determined. A comparison is also given with the B-X and A-X transitions. In addition, the dissociation energy of the OD bond in HOD has been determined accurately to be 41751.3±5 cm-1.
基金Project supported by the National Natural Science Foundation of China(Grant No.11174218)
文摘The branching ratios of ions and the angular distributions of electrons ejected from the Eu 4f^76p_(1/2)nd auto-ionizing states are investigated with the velocity-map-imaging technique.To populate the above auto-ionizing states,the relevant bound Rydberg states have to be detected first.Two new bound Rydberg states are identified in the region between41150 cm^(-1)and 44580 cm^(-1),from which auto-ionization spectra of the Eu 4f^76p_(1/2)nd states are observed with isolated core excitation method.With all preparations above,the branching ratios from the above auto-ionizing states to different final ionic states and the angular distributions of electrons ejected from these processes are measured systematically.Energy dependence of branching ratios and anisotropy parameters within the auto-ionization spectra are carefully analyzed,followed by a qualitative interpretation.
基金supported by the National Natural Science Foundation of China (No.21573027 to Jun Li)the US Department of Energy (DE-SC0015997 to Hua Guo)
文摘The hydrogen abstraction reaction F+CH3OH has two possible reaction pathways: HF+CH3O and HF+CH2OH. Despite the absence of intrinsic barriers for both channels, the former has a branching ratio comparable to the latter, which is far from the statistical limit of 0.25 (one out of four available H atoms). Furthermore, the measured branching ratio of the two abstraction channels spans a large range and is not quantitatively reproduced by previous theoretical predictions based on the transition-state theory with the stationary point information calculated at the levels of MФller-Plesset perturbation theory and G2. This work reports a theoretical investigation on the kinetics and the associated branching ratio of the two competing channels of the title reaction using a quasi-classical trajectory approach on an accurate full-dimensional potential energy surface (PES) fitted by the permutation invariant polynomial-neural network approach to ca. 1.21x10^5 points calculated at the explicitly correlated (F12a) version of coupled cluster singles doubles and perturbative triples (CCSD(T)) level with the aug-cc-pVDZ basis set. The calculated room temperature rate coeffcient and branching ratio of the HF+CH3O channel are in good agreement with the available experimental data. Furthermore, our theory predicts that rate coeffcients have a slightly negative temperature dependence, consistent with barrierless nature of the reaction.
文摘A detailed investigation of different decay modes,namely alpha decay,beta decay,cluster decay including heavy particle emission(Z_(c)>28),and spontaneous fission,was carried out,leading to the identification of new cluster and beta-plus emitters in superheavy nucle with 104≤Z≤126.For the first time,we identified around20 beta-plus emitters in superheavy nuclei.Heavy-particle radioactivity was observed in superheavy elements of atomic number in the range 116≤Z≤126.^(292-293)Og were identified as ^(86)Kr emitters,and ^(298)122 and ^(300)122 were identified as ^(94)Zr emitters,whereas heavy-particle radioactivity from ^(91)Y was also observed in ^(299)123.Furthermore,the nuclei ^(300)124 and ^(306)126 exhibit ^(96)Mo radioactivity.The reported regions of beta-plus and heavyparticle radioactivity for superheavy nuclei are stronger than those for alpha decay.The identified decay modes for superheavy nuclei are presented in a chart.This study is intended to serve as a reference for identifying possible decay modes in the superheavy region.
文摘The quasi-classical trajectory calculation for the reaction O(^1D)+HD is carried out based on the Dobbyn and Knowles potential energy surface. In this work, the reaction cross section and product branching ratio are obtained. The product branching ratio OD/OH was discussed. The calculated results show that the cross-section decreases thoroughly with the increasing of the collision energy from 4.6 kJ/mol to 46.0 kJ/mol. The average branching ratio decrease with the increase of rotational quantum number of reactant HD.
基金Supported by the National Natural Science Foundation of China under Grant Nos. 10575052, 10605012, and 10735080
文摘In this article, we calculate the branching ratios of B→K0^* (1430)K decays by employing the pertur-bative QCD (pQCD) approach at leading order. We perform the evaluations in the two scenarios for the scalar meson spectrum. We find that (i) The leading order pQCD predictions for the branching ratio Br(B^+→K^+K0^*(1430)^0)are in good agreement with the experimental upper limit in both scenarios, while the pQCD predictions for other considered B→K0^*(1430)K decay modes are also presented and will be tested by the LHC experiments; (ii) The annihilation contributions play an important role in these considered decays, for B^0→K0^*(1430)^±K^± decays,for example,which are found to be (1-4)×10^-6.
基金Supported by the National Natural Science Foundation of China under Grant No.10575052,10605012,and 10735080
文摘By employing the perturbative QCD (pQCD) factorization approach, we calculate some important next- to-leading-order (NLO) contributions to the two-body charmless hadronic decays B^+ →ρ^+η(') and B^0 → ρ^0(ω, φ)η('), induced by the vertex QCD corrections, the quark-loops as well as the chromo-magnetic penguins. From the numerical results and phenomenological analysis we find that (a) for B^± → ρ^±η(') (B^0 → ρ^0(ω, φ)η(')decays, the partial NLO contributions to branching ratios are small (large) in magnitude; and (b) the pQCD predictions for ACP^dir(B^± → ρ^±η(')) are consistent with the data, while the predicted .ACP(B^0 → ρ^0(ω)η(')) are generally large in magnitude and could be tested by the forthcoming LHCb experiments.
基金Supported by National Natural Science Foundation of China under Grant No.11047158by Foundation of Henan University of Technology under Grant No.2009BS038
文摘In the two-quark model supposition for the meson ao(1450), which can be viewed as either the first excited state (scenario I) or the lowest lying state (scenario II), the branching ratios and the direct CP-violating asymmetries for decays B→a0(1450)ρ(ω) are studied by employing the perturbative QCD factorization approach. We find the following results: (a) For the decays B- B→a0(1450)ρ- andB→a0^+(1450)ρ^-, their branching ratios have large difference between two scenarios. Although their branching ratios are larger than other considered decay modes, their direct CP-violating asymmetries in both scenarios are small. (b) For the decays B-→a0^-(1450)ρ0 and B0→ a0(1450)ρ+, a0^0(1450)ρ0, a00 (1450)w, their branching ratios are dose to each other between two scenarios, respectively. (c) Comparing with the decays a0^0(1450)ρ0,π0ρ0 π0π0, the decay B-→a0^-(1450)ρ0 receives a larger branching ratio in each scenario, which is sensitive to the variation of the Cabibbo-Kobayashi-Maskawa angle α.
基金National Natural Science Foundation of China under Grant No.10575052the Specialized Research Fund for the Doctoral Program of Higher Education (SRFDP) under Grant No.20050319008the Special Study Foundation of Nanyang Normal University under Grant No.nynu200750
文摘Using the form factors from light-cone sum rules, we study the branching ratios and forward-backward asymmetries (FBAs) of the exclusive decays Bu^+→π^+e^+e^- and Bu^+ →ρ^+e^+e^- (e= e,μ) in the standard model (SM) and the top quark two-Higgs-doublet model (T2HDM). From the numerical results, we find that the new physics contributions cannot provide very large enhancement to the branching ratios and the theoretical predictions are in good agreement with the SM ones. The T2HDM effects on FBAs of these decays are small. Precision measurements of the dilepton invariant mass distributions, especially in the lower dilepton mass region, and the FBAs in the decays Bu^+ → π^+ (ρ^+ )e^+ e^- will greatly help in discriminating among the SM and the new physics models.
基金supported by the National Natural Science Foundation of China(No.91641116,No.21433004,No.91753103,and No.21933010)the NYU Global Seed Grantthe Laboratory and Equipment Management Office of ECNU。
文摘The product branching ratio between different products in multichannel reactions is as important as the overall rate of reaction,both in terms of practical applications(e.g.models of combustion or atmosphere chemistry)in understanding the fundamental mechanisms of such chemical reactions.A global ground state potential energy surface for the dissociation reaction of deuterated alkyl halide CD_(3)CH_(2)F was computed at the CCSD(T)/CBS//B3 LYP/aug-cc-p VDZ level of theory for all species.The decomposition of CD_(3)CH_(2)F is controversial concerning C-F bond dissociation reaction and molecular(HF,DF,H_(2),D_(2),HD)elimination reaction.RiceRamsperger-Kassel-Marcus(RRKM)calculations were applied to compute the rate constants for individual reaction steps and the relative product branching ratios for the dissociation products were calculated using the steady-state approach.At the different energies studied,the RRKM method predicts that the main channel for DF or HF elimination from1,2-elimination of CD_(3)CH_(2)F is through a four-center transition state,whereas D_(2) or H_(2) elimination from 1,1-elimination of CD_(3)CH_(2)F occurs through a direct three-center elimination.At 266,248,and 193 nm photodissociation,the main product CD_(2)CH_(2)+DF branching ratios are computed to be 96.57%,91.47%,and 48.52%,respectively;however,at 157 nm photodissociation,the product branching ratio is computed to be 16.11%.Based on these transition state structures and energies,the following photodissociation mechanisms are suggested:at 266,248,193 nm,CD_(3)CH_(2)F→absorption of a photon→TS5→the formation of the major product CD_(2)CH_(2)+DF;at 157 nm,CD_(3)CH_(2)F→absorption of a photon→D/F interchange of TS1→CDH_(2)CDF→H/F interchange of TS2→CHD_(2)CHDF→the formation of the major product CHD_(2)+CHDF.
基金Supported by the National Natural Science Foundation of China under Grant Nos. 10947020 and 11005033Foundation of Henan Educational Committee for Youth Backbone Scholars in Colleges and Universities+1 种基金the Natural Science Foundation of the Eduction Department of Henan Province under Grant No. 2010A140012Natural Science Foundation of Henan Province under Grant No. 102300410210
文摘Based on the low energy effective Hamiltonian with naive factorization, we calculate the branching ratios (BRs) and CP asymmetries (CPAs) for the twenty three double charm decays B/B8 → D(*)D(*) in both the standard (s) (s) model (SM) and the minimal supergravity (mSUGRA) model. Within the considered parameter space, we find that (a) the theoretical predictions for the BRs, CPAs and the polarization fractions in the SM and the mSUGRA model are all consistent with the currently available data within ±2σ errors; (b) For all the considered decays, the supersymmetric contributions in the mSUGRA model are very small, less than 7% numerically. It may be difficult to observe so small SUSY contributions even at LHC.
文摘We calculate the flavor changing decay in the framework of the topcolor assisted multiscale technicolor model. We find that (a) the branching ratio of is insensitive to and , while it increases quickly as increases; (b) for reasonable ranges of the parameters, the maximum of the branching ratio in this model may reach , seven orders larger compared to the one calculated in the standard model. This might provide an opportunity to detect the rare decay of the top quark in experiments.
基金supported in part by the National Natural Science Foundation of China under Grant No.10675057Foundation of Liaoning Education Committee under Grant No.2007T086
文摘Rare decay processes K→πvv^- and KL→π^0vv^- are considered in the framework of three-site Higgsless model. The contributions of this new physics model to these two decay processes come from the new heavy gauge bosons and the correction terms for the couplings of the ordinary gauge bosons with fermions. Our numerical results show that the branching ratios of these two decay processes can be enhanced by 40% and 50% relative to those predicted by the standard model.
基金supported by the National Natural Science Foundation of China(No.21973009)the Chongqing Municipal Natural Science Foundation(No.cstc2019jcyj-msxm X0087)the Venture and Innovation Support Program for Chongqing Overseas Returnees(No.cx2021071)。
文摘The H+CH_(3) OH reaction,which plays an important role in combustion and the interstellar medium,presents a prototypical system with multiple channels.In this work,mode specific dynamics of different product channels is investigated theoretically on a recently developed reliable potential energy surface based on a large number of data points calculated at the level of UCCSD(T)-F12 a/AVTZ.It has been demonstrated that vibrational excitations of the O-H stretching motion,the torsional motion,the C-H stretching vibrations,show different infuences on the four product channels,H_(2)+CH_(3) O,H_(2)+CH_(2)OH,H_(2) O+CH_(3),and H+CH_(3) OH.This work is helpful for understanding the mode-specific dynamics and controlling the competition for complicated reactions with multiple product channels.
基金The project partially supported by National Natural Science Foundation of China under Grant Nos. 10275035 and 10575052 and the Specialized Research Fund for Doctoral Program of Higher Education (SRFDP) under Grant No. 20050319008.We are very grateful to GU0 Li-Bo for helpful discussions.
文摘By employing the QCD factorization approach for the exclusive B→Vу decays, we study the exclusive decay B→K^*у in the top-quark two-Higgs-doublet mode/(T2HDM). Within the considered parameter space, we find the following conclusions (a) A hght charged-Higgs boson with a mass about 200 GeV is clearly excluded by the date of B→K^*у decay, and this lower limit is comparable with that from the inclusive B→X8*у decay; (b) The theoretical predictions for CP asymmetry of B→K^*у in the T2HDM is always less than 1% in size; and (c) The isospin symmetry breaking for B→K^*у decay in the SM and T2HDM considered here is around 6% in size and well consistent with the data and the general expectations.