Piotr de Silva

Piotr de Silva

Adjunkt

DTU ENERGI
Institut for Energikonvertering og -lagring

Danmarks Tekniske Universitet

Fysikvej

Bygning 309, rum 140

2800 Kgs. Lyngby

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Publikationer
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2019
 

Extracting Design Principles for Efficient Thermally Activated Delayed Fluorescence (TADF) from a Simple Four-State Model

de Silva, Piotr ; Kim, Changhae Andrew ; Zhu, Tianyu ; Voorhis, Troy Van
in: Chemistry of Materials, vol: 31, issue: 17, pages: 6995-7006

Type: Journal article (Peer reviewed)

Status: Published     |    År: 2019     |    DOI: https://doi.org/10.1021/acs.chemmater.9b01601

 

On the Inverted Singlet-Triplet Gaps and Their Relevance to Thermally-Activated Delayed Fluorescence

de Silva, Piotr
in: The Journal of Physical Chemistry Letters, vol: 10, issue: 18, pages: 5674-5679

Type: Journal article (Peer reviewed)

Status: Published     |    År: 2019     |    DOI: https://doi.org/10.1021/acs.jpclett.9b02333

 

Unexpectedly Large Couplings Between Orthogonal Units in Anthraquinone Polymers

Fornari, Rocco P. ; de Silva, Piotr
in: Chemistry: A European Journal, vol: 25, issue: 64, pages: 14651-14658

Type: Journal article (Peer reviewed)

Status: Published     |    År: 2019     |    DOI: https://doi.org/10.1002/chem.201903227

2018
 

QM/MM Study of Static and Dynamic Energetic Disorder in the Emission Layer of an Organic Light-Emitting Diode

de Silva, Piotr ; Voorhis, Troy Van
in: The Journal of Physical Chemistry Letters, vol: 9, pages: 1329-1334

Type: Journal article (Peer reviewed)

Status: Published     |    År: 2018     |    DOI: https://doi.org/10.1021/acs.jpclett.8b00040

2017
 

Long-range interactions from the many-pair expansion: A different avenue to dispersion in DFT

de Silva, Piotr ; Zhu, Tianyu ; Voorhis, Troy Van
in: Journal of Chemical Physics, vol: 146

Type: Journal article (Peer reviewed)

Status: Published     |    År: 2017     |    DOI: https://doi.org/10.1063/1.4973728

 

Self-Attractive Hartree Decomposition: Partitioning Electron Density into Smooth Localized Fragments

Zhu, Tianyu ; de Silva, Piotr ; Voorhis, Troy Van
in: Journal of Chemical Theory and Computation

Type: Journal article (Peer reviewed)

Status: Accepted/In press     |    År: 2017     |    DOI: https://doi.org/10.1021/acs.jctc.7b00931

 

Shorter Exciton Lifetimes via an External Heavy‐Atom Effect: Alleviating the Effects of Bimolecular Processes in Organic Light‐Emitting Diodes

Einzinger, Markus ; Zhu, Tianyu ; de Silva, Piotr ; Belger, Christian ; Swager, Timothy M. ; Voorhis, Troy Van ; Baldo, Marc A.
in: Advanced Materials, vol: 29, issue: 40

Type: Journal article (Peer reviewed)

Status: Published     |    År: 2017     |    DOI: https://doi.org/0.1002/adma.201701987

2016
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Many-electron expansion: A density functional hierarchy for strongly correlated systems

Zhu, Tianyu ; de Silva, Piotr ; van Aggelen, Helen ; Van Voorhis, Troy
in: Physical Review B, vol: 93, issue: 20

Type: Journal article

Status: Published     |    År: 2016     |    DOI: https://doi.org/10.1103/PhysRevB.93.201108

 

Visualizing and Quantifying Interactions in the Excited State

Vannay, Laurent ; Bremond, Eric ; de Silva, Piotr ; Corminboeuf, Clemence
in: Chemistry-a European Journal, vol: 22, issue: 51, pages: 18442-18449

Type: Journal article (Peer reviewed)

Status: Published     |    År: 2016     |    DOI: https://doi.org/10.1002/chem.201603914

2015
 

Communication: A new class of non-empirical explicit density functionals on the third rung of Jacob’s ladder

de Silva, Piotr ; Corminboeuf, Clemence
in: Journal of Chemical Physics, vol: 143

Type: Journal article (Peer reviewed)

Status: Published     |    År: 2015     |    DOI: https://doi.org/10.1063/1.4931628