The highly excited vibrational states of quasi-linear tetraatomic molecule HCNO are studied in the framework of U(4) algebra. By using symmetric group with which the tetraatomic molecules satisfy, we construct the alg...The highly excited vibrational states of quasi-linear tetraatomic molecule HCNO are studied in the framework of U(4) algebra. By using symmetric group with which the tetraatomic molecules satisfy, we construct the algebraic Hamiltonian that not only includes Majorana operator M 12 but also M 13 and M 23 which are very useful for getting potential energy surface and force constants in Lie algebra method. And the eigenvalue of the Hamiltonian are obtained by Lie algebra treatment.展开更多
An analytical expression of the propagator is obtained by using Lie algebramethod.The fission rates at the saddle point in both constant and coordinate-dependentmass,friction and temperature cases are calculated based...An analytical expression of the propagator is obtained by using Lie algebramethod.The fission rates at the saddle point in both constant and coordinate-dependentmass,friction and temperature cases are calculated based on the expression of thepropagator and local approximation.The numerical calculation for <sup>240</sup>pu shows thatthe fission rates from our method are reasonable.展开更多
The highly excited vibrational states of asymmetric linear tetratomic molecules are studied in the framework of Lie algebra. By using symmetric group U1(4) U2(4) U3(4), we construct the Hamiltonian that includes not o...The highly excited vibrational states of asymmetric linear tetratomic molecules are studied in the framework of Lie algebra. By using symmetric group U1(4) U2(4) U3(4), we construct the Hamiltonian that includes not only Casimir operators but also Majorana operators M12,M13 and M23, which are useful for getting potential energy surface and force constants in Lie algebra method. By Lie algebra treatment, we obtain the eigenvalues of the Hamiltonian, and make the concrete calculation for molecule C2HF.展开更多
文摘The highly excited vibrational states of quasi-linear tetraatomic molecule HCNO are studied in the framework of U(4) algebra. By using symmetric group with which the tetraatomic molecules satisfy, we construct the algebraic Hamiltonian that not only includes Majorana operator M 12 but also M 13 and M 23 which are very useful for getting potential energy surface and force constants in Lie algebra method. And the eigenvalue of the Hamiltonian are obtained by Lie algebra treatment.
文摘An analytical expression of the propagator is obtained by using Lie algebramethod.The fission rates at the saddle point in both constant and coordinate-dependentmass,friction and temperature cases are calculated based on the expression of thepropagator and local approximation.The numerical calculation for <sup>240</sup>pu shows thatthe fission rates from our method are reasonable.
基金the National Natural Science Foundation of China (Grant No. 20173031)the State Key Laboratory of Theoretical and Computational Chemistry of Jilin University at Changchun (Grant No. 9801)the Science Foundation of Shandong Province of China (Grant No.Y98B08027)
文摘The highly excited vibrational states of asymmetric linear tetratomic molecules are studied in the framework of Lie algebra. By using symmetric group U1(4) U2(4) U3(4), we construct the Hamiltonian that includes not only Casimir operators but also Majorana operators M12,M13 and M23, which are useful for getting potential energy surface and force constants in Lie algebra method. By Lie algebra treatment, we obtain the eigenvalues of the Hamiltonian, and make the concrete calculation for molecule C2HF.
