Browse by Person

Up a level
Export as [feed] Atom [feed] RSS 1.0 [feed] RSS 2.0
Group by: Item Type | No Grouping
Jump to: Article
Number of items: 9.

Article

Symonds, CC orcid.org/0000-0001-7952-3805, Makhov, DV, Cole-Filipiak, NC et al. (3 more authors) (2019) Ultrafast photodissociation dynamics of pyrazole, imidazole and their deuterated derivatives using ab initio multiple cloning. Physical chemistry chemical physics : PCCP, 21 (19). pp. 9987-9995. ISSN 1463-9076

Green, JA orcid.org/0000-0002-5036-3104, Makhov, DV, Cole-Filipiak, NC et al. (3 more authors) (2019) Ultrafast photodissociation dynamics of 2-ethylpyrrole: adding insight to experiment with ab initio multiple cloning. Physical Chemistry Chemical Physics, 21 (7). pp. 3832-3841. ISSN 1463-9076

Makhov, DV and Shalashilin, DV orcid.org/0000-0001-6104-1277 (2018) Floquet Hamiltonian for incorporating electronic excitation by a laser pulse into simulations of non-adiabatic dynamics. Chemical Physics, 515. pp. 46-51. ISSN 0301-0104

Freixas, VM, Fernandez-Alberti, S, Makhov, DV et al. (2 more authors) (2018) An ab initio multiple cloning approach for the simulation of photoinduced dynamics in conjugated molecules. Physical Chemistry Chemical Physics, 20 (26). pp. 17762-17772. ISSN 1463-9076

Makhov, DV, Symonds, C, Fernandez-Alberti, S et al. (1 more author) (2017) Ab initio quantum direct dynamics simulations of ultrafast photochemistry with Multiconfigurational Ehrenfest approach. Chemical Physics, 493. pp. 200-218. ISSN 0301-0104

Makhov, DV, Martinez, TJ and Shalashilin, DV (2016) Toward Fully Quantum Modelling of Ultrafast Photodissociation Imaging Experiments. Treating Tunnelling in the Ab Initio Multiple Cloning Approach. Faraday Discussions, 194. pp. 81-94. ISSN 1359-6640

Fernandez-Alberti, S, Makhov, DV, Tretiak, S et al. (1 more author) (2016) Non-Adiabatic Excited State Molecular Dynamics of Phenylene Ethynylene Dendrimer Using Multiconfigurational Ehrenfest Approach. Physical Chemistry Chemical Physics, 2016 (18). pp. 10028-10040. ISSN 1463-9076

Makhov, DV, Saita, K, Martinez, TJ et al. (1 more author) (2015) Ab initio multiple cloning simulations of pyrrole photodissociation: TKER spectra and velocity map imaging. Physical Chemistry Chemical Physics, 17 (5). pp. 3316-3325. ISSN 1463-9076

Makhov, DV, Glover, WJ, Martinez, TJ et al. (1 more author) (2014) Ab initio multiple cloning algorithm for quantum nonadiabatic molecular dynamics. Journal of Chemical Physics, 141 (5). 054110. ISSN 0021-9606

This list was generated on Sun Oct 13 03:36:21 2019 BST.