当前位置: X-MOL 学术Comput. Phys. Commun. › 论文详情
Our official English website, www.x-mol.net, welcomes your feedback! (Note: you will need to create a separate account there.)
RMT: R-matrix with time-dependence. Solving the semi-relativistic, time-dependent Schrödinger equation for general, multi-electron atoms and molecules in intense, ultrashort, arbitrarily polarized laser pulses
Computer Physics Communications ( IF 7.2 ) Pub Date : 2020-05-01 , DOI: 10.1016/j.cpc.2019.107062
Andrew C. Brown , Gregory S.J. Armstrong , Jakub Benda , Daniel D.A. Clarke , Jack Wragg , Kathryn R. Hamilton , Zdeněk Mašín , Jimena D. Gorfinkiel , Hugo W. van der Hart

RMT is a program which solves the time-dependent Schrodinger equation for general, multielectron atoms, ions and molecules interacting with laser light. As such it can be used to model ionization (single-photon, multi-photon and strong-field), recollision (high-harmonic generation, strong-field rescattering), and more generally absorption or scattering processes with a full account of the multielectron correlation effects in a time-dependent manner. Calculations can be performed for targets interacting with ultrashort, intense laser pulses of long-wavelength and arbitrary polarization. Calculations for atoms can optionally include the Breit-Pauli correction terms for the description of relativistic (in particular, spin-orbit) effects.

中文翻译:

RMT:具有时间相关性的 R 矩阵。求解强、超短、任意偏振激光脉冲中一般多电子原子和分子的半相对论、时间相关薛定谔方程

RMT 是一个程序,用于解决与激光相互作用的一般多电子原子、离子和分子的时间相关薛定谔方程。因此,它可用于模拟电离(单光子、多光子和强场)、再碰撞(高谐波产生、强场再散射)以及更普遍的吸收或散射过程,并充分考虑多电子以时间相关的方式产生相关效应。可以对与长波长和任意偏振的超短、强激光脉冲相互作用的目标进行计算。原子的计算可以选择性地包括 Breit-Pauli 校正项,用于描述相对论(特别是自旋轨道)效应。
更新日期:2020-05-01
down
wechat
bug