位置：成果数据库 > 期刊 > 期刊详情页
Frozen Gaussian series representation of the imaginary time propagator theory and numerical tests
  • ISSN号：0021-9606
  • 期刊名称：Journal of Chemical Physics
  • 时间：0
  • 页码：044116-1-044116-9
  • 相关项目：态态分子反应动力学的实验与理论研究
作者： Zhang, Dong H.|Shao, Jiushu|Pollak, Eli|
同期刊论文项目
态态分子反应动力学的实验与理论研究
期刊论文 55
同项目期刊论文
Effect of defects on photocatalytic dissociation of methanol on TiO2(110)
Observation of extremely high vibrational excitation in O2 from inelastic scattering of rydberg H at
Ring Polymer Molecular Dynamics Calculations of Thermal Rate Constants for the O(3P) + CH4 -〉 OH + C
Rotational state specific dissociation dynamics of D2O via the C electronic state
Predissociation dynamics of N2O+ at the A( (2)Sigma +)state: Three pathways to form NO+ (((1)Sigma+)
Quantum state-selected photodissociation dynamics of H2O: Two-photon dissociation via the C electron
Crossed molecular beam ion-imaging study of the Cl+SiH4 -〉HCl + SiH3 reaction: product vibrational s
QCT and QM calculations of the Cl(2P) + NH3 reaction: influence of the reactant well on the dynamics
Imaging CH3SH photodissociation at 204 nm: the SH + CH3 channel
Kinetics and dynamics of the NH3 + H -〉NH2 + H2 reaction using transition state methods, quasi-class
Rotational State Specific Dissociation Dynamics of HOD -〉H+ OD via Two-Photon Excitation to the B El
Photodissociation of HOD via the e C1B1 State: OD/OH Branching Ratio and OD Bond Dissociation Energy
Comparison of second-order split operator and Chebyshev propagator in wave packet based state-to-sta
Theoretical investigation of the direct observation of anharmonic coupling in CDCl3 in the time doma
A Reactant-Coordinate-Based Time-Dependent Wave Packet Method for Triatomic State-to-State Reaction
NH(X-3 Sigma)+H/D(S-2) -〉H(S-2) plus NH/ND(X-3 Sigma) exchange reactions: State-to-state quantum sca
Identifying Tm@C-82 isomers with density functional theory calculations
A six-dimensional wave packet study of the vibrational overtone induced decomposition of hydrogen pe
Mode Selectivity for a Central Barrier Reaction: Eight-Dimensional Quantum Studies of the O(3P) + CH
An eight-dimensional quantum mechanical Hamiltonian for X + YCZ3 system and its applications to H +
State-to-state differential cross-sections for the reactive scattering of H*(n) with o-D2
Imaging the O(D-1)+CD4 －〉OD+CD3 Reaction Dynamics: The Threshold of Abstraction Pathway
Imaging the O(D-1)+CD4 -> OD+CD3 Reaction Dynamics: The Threshold of Abstraction Pathway
A full-dimensional time-dependent wave packet study of the OH+CO -〉H+CO2 reaction
Understanding the Interaction between Valsartan and Detergents by NMR Techniques and Molecular Dynam
Modified Shepard interpolation of gas-surface potential energy surfaces with strict plane group symm
AT1受体拮抗剂缬沙坦化学位移的量子化学计算研究