Modeling of seismic responses of variable permeability on the basis of the patchy-sa^ration model provides insights into the seismic characterization of fluid mobility. We linked rock-physics models in the frequency d...Modeling of seismic responses of variable permeability on the basis of the patchy-sa^ration model provides insights into the seismic characterization of fluid mobility. We linked rock-physics models in the frequency domain and seismic modeling on the basis of the propagator matrix method. For a layered patchy-saturated reservoir, the seismic responses represent a combination of factors, including impedance contrast, the effect of dispersion and attenuation within the reservoir, and the tuning and interference of reflections at the top and bottom of the reservoir. Numerical results suggest that increasing permeability significantly reduces the P-wave velocity and induces dispersion between the high- and low-frequency elastic limit. Velocity dispersion and the layered structure of a reservoir lead to complex reflection waveforms. Seismic reflections are sensitive to permeability if the impedance of the reservoir is close to that of the surroundings. For variable layer thickness, the stacked amplitudes increase with permeability for high-velocity surrounding shale, whereas the stacked amplitudes decrease with permeability for low-velocity surrounding shale.展开更多
We propose a method for calculating the nonradiative decay rates for polyatomic molecules including anharmonic effects of the potential energy surface(PES)in the Franck-Condon region.The method combines the n-mode rep...We propose a method for calculating the nonradiative decay rates for polyatomic molecules including anharmonic effects of the potential energy surface(PES)in the Franck-Condon region.The method combines the n-mode repre-sentation method to construct the ab initio PES and the nearly exact time-dependent density matrix renormalization group method(TD-DMRG)to simulate quantum dynamics.In addition,in the framework of TD-DMRG,we further develop an algorithm to calculate the final-state-resolved rate coefficient which is very useful to analyze the contribution from each vibrational mode to the transition process.We use this method to study the internal conversion(IC)process of azulene after taking into account the anharmonicity of the ground state PES.The results show that even for this semi-rigid molecule,the intramode anharmonicity enhances the IC rate significantly,and after considering the two-mode coupling effect,the rate increases even further.The reason is that the anharmonicity enables the C-H vibrations to receive electronic energy while C-H vibrations do not contribute on the harmonic PES as the Huang-Rhys factor is close to 0.展开更多
基金sponsored by the National Natural Science Foundation of China(Nos 41404090 and U1262208)the Foundation of the SINOPEC Key Laboratory of Geophysics(No.33550006-14-FW2099-0029)
文摘Modeling of seismic responses of variable permeability on the basis of the patchy-sa^ration model provides insights into the seismic characterization of fluid mobility. We linked rock-physics models in the frequency domain and seismic modeling on the basis of the propagator matrix method. For a layered patchy-saturated reservoir, the seismic responses represent a combination of factors, including impedance contrast, the effect of dispersion and attenuation within the reservoir, and the tuning and interference of reflections at the top and bottom of the reservoir. Numerical results suggest that increasing permeability significantly reduces the P-wave velocity and induces dispersion between the high- and low-frequency elastic limit. Velocity dispersion and the layered structure of a reservoir lead to complex reflection waveforms. Seismic reflections are sensitive to permeability if the impedance of the reservoir is close to that of the surroundings. For variable layer thickness, the stacked amplitudes increase with permeability for high-velocity surrounding shale, whereas the stacked amplitudes decrease with permeability for low-velocity surrounding shale.
基金supported by the National Natural Science Foundation of China through the Project "Science Center for Luminescence from Molecular Aggregates(SCELMA)" (No.21788102)the Ministry of Science and Technology of China through the National Key R&D Plan (No.2017YFA0204501)supported by the National Natural Science Foundation of China (No.22003029)
文摘We propose a method for calculating the nonradiative decay rates for polyatomic molecules including anharmonic effects of the potential energy surface(PES)in the Franck-Condon region.The method combines the n-mode repre-sentation method to construct the ab initio PES and the nearly exact time-dependent density matrix renormalization group method(TD-DMRG)to simulate quantum dynamics.In addition,in the framework of TD-DMRG,we further develop an algorithm to calculate the final-state-resolved rate coefficient which is very useful to analyze the contribution from each vibrational mode to the transition process.We use this method to study the internal conversion(IC)process of azulene after taking into account the anharmonicity of the ground state PES.The results show that even for this semi-rigid molecule,the intramode anharmonicity enhances the IC rate significantly,and after considering the two-mode coupling effect,the rate increases even further.The reason is that the anharmonicity enables the C-H vibrations to receive electronic energy while C-H vibrations do not contribute on the harmonic PES as the Huang-Rhys factor is close to 0.