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List of works by Dmitri Kilin

Defect Tolerance Mechanism Revealed! Influence of Polaron Occupied Surface Trap States on CsPbBr<sub>3</sub> Nanocrystal Photoluminescence: <i>Ab Initio</i> Excited-State Dynamics

scientific article published on 20 October 2021

Dynamics of Charge Transfer and Multiple Exciton Generation in the Doped Silicon Quantum Dot-Carbon Nanotube System: Density Functional Theory-Based Computation

article

Excited-State Dynamics of a CsPbBr3 Nanocrystal Terminated with Binary Ligands: Sparse Density of States with Giant Spin-Orbit Coupling Suppresses Carrier Cooling

scientific article published on 27 February 2019

First-Principles Molecular Dynamics of Monomethylhydrazine and Nitrogen Dioxide

scientific article published on 30 April 2019

Multiple exciton generation in chiral carbon nanotubes: Density functional theory based computation.

scientific article published in October 2017

Nonradiative Relaxation Dynamics of a Cesium Lead Halide Perovskite Photovoltaic Architecture: Effect of External Electric Fields

scientific article published on 12 November 2020

Photofragmentation of Tetranitromethane: Spin-Unrestricted Time-Dependent Excited-State Molecular Dynamics

scientific article

Photoinduced Charge Transfer versus Fragmentation Pathways in Lanthanum Cyclopentadienyl Complexes

scientific article published on 26 June 2017

Photoinduced Single- and Multiple-Electron Dynamics Processes Enhanced by Quantum Confinement in Lead Halide Perovskite Quantum Dots.

scientific article published on 21 March 2017

Quantitative Attachment of Bimetal Combinations of Transition-Metal Ions to the Surface of TiO2 Nanorods

scientific article published on 30 April 2018

Quantum Zeno Effect Rationalizes the Phonon Bottleneck in Semiconductor Quantum Dots ⬇️

scientific article published on 02 May 2013

Singlet fission in chiral carbon nanotubes: Density functional theory based computation

scientific article published in July 2017

Theoretical predictions on efficiency of bi-exciton formation and dissociation in chiral carbon nanotubes

scientific article published on 01 October 2016

Unexpected high binding energy of CO2 on CH3NH3PbI3 lead-halide organic-inorganic perovskites via bicarbonate formation

scientific article published on 01 August 2018

Unraveling Photodimerization of Cyclohexasilane from Molecular Dynamics Studies

scientific article published on 20 July 2018

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