The phase space CCS approach to quantum and semiclassical molecular dynamics for high-dimensional systems von Shalashilin, Dmitrii V, Child, Mark S

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Real time quantum propagation on a Monte Carlo trajectory guided grids of coupled coherent states: 26D simulation of pyrazine absorption spectrum von Shalashilin, Dmitrii V, Child, Mark S

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Multidimensional quantum propagation with the help of coupled coherent states von Shalashilin, Dmitrii V., Child, Mark S.

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Time dependent quantum propagation in phase space von Shalashilin, Dmitrii V., Child, Mark S.

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Locally coupled coherent states and Herman–Kluk dynamics von Child, M. S., Shalashilin, D. V.

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Description of tunneling with the help of coupled frozen Gaussians von Shalashilin, Dmitrii V., Child, Mark S.

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Eley–Rideal and hot-atom reactions of H(D) atoms with D(H)-covered Cu(111) surfaces; quasiclassical studies von Shalashilin, Dmitrii V., Jackson, Bret, Persson, Mats

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Zombie states for description of structure and dynamics of multi-electron systems von Shalashilin, DV

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Nine-dimensional quantum molecular dynamics simulation of intramolecular vibrational energy redistribution in the CHD3 molecule with the help of coupled coherent states von Shalashilin, Dmitrii V., Child, Mark S.

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Formation and dynamics of hot-precursor hydrogen atoms on metal surfaces: Trajectory simulations and stochastic models von Shalashilin, Dmitrii V., Jackson, Bret

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Electronic energies from coupled fermionic "Zombie" states' imaginary time evolution von Bramley, OA, Hele, TJH, Shalashilin, DV

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Electronic energies from coupled fermionic "Zombie" states' imaginary time evolution von Bramley, OA, Hele, TJH, Shalashilin, DV

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Simulation of the effect of vibrational pre-excitation on the dynamics of pyrrole photo-dissociation von Makhov, DV, Shalashilin, DV

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Quantum initial value representation simulation of water trimer far infrared absorption spectrum von Shalashilin, D V, Child, M S, Clary, D C

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A first-principles potential energy surface for Eley–Rideal reaction dynamics of H atoms on Cu(111) von Persson, M., Strömquist, J., Bengtsson, L., Jackson, B., Shalashilin, D. V., Hammer, B.

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Simulation of the dynamics of vibrationally mediated photodissociation for deuterated pyrrole von Makhov, DV, Adeyemi, S, Cowperthwaite, M, Shalashilin, DV

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Initial value representation for the classical propagator and S-matrix with the help of coherent states von Shalashilin, Dmitrii V., Jackson, Bret

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Dynamics of a one-dimensional Holstein polaron: The multiconfigurational Ehrenfest method von Chen, L, Gelin, MF, Shalashilin, DV

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ChemDyME: Kinetically Steered, Automated Mechanism Generation through Combined Molecular Dynamics and Master Equation Calculations von Shannon, RJ, Martínez-Núñez, E, Shalashilin, DV, Glowacki, DR

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Guiding paths and time-dependent basis sets for wavefunction propagation von Shalashilin, Dmitrii V., Jackson, Bret

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