Kinetics of molecular decomposition under irradiation of gold nanoparticles with nanosecond laser pulses—A 5-Bromouracil case study (Englisch)
- Neue Suche nach: Marques, Telma S.
- Neue Suche nach: Schürmann, Robin
- Neue Suche nach: Ebel, Kenny
- Neue Suche nach: Heck, Christian
- Neue Suche nach: Śmiałek, Małgorzata A.
- Neue Suche nach: Eden, Sam
- Neue Suche nach: Mason, Nigel
- Neue Suche nach: Bald, Ilko
- Neue Suche nach: Marques, Telma S.
- Neue Suche nach: Schürmann, Robin
- Neue Suche nach: Ebel, Kenny
- Neue Suche nach: Heck, Christian
- Neue Suche nach: Śmiałek, Małgorzata A.
- Neue Suche nach: Eden, Sam
- Neue Suche nach: Mason, Nigel
- Neue Suche nach: Bald, Ilko
In:
The Journal of Chemical Physics
;
152
, 12
;
8
;
2020
- Aufsatz (Zeitschrift) / Elektronische Ressource
-
Titel:Kinetics of molecular decomposition under irradiation of gold nanoparticles with nanosecond laser pulses—A 5-Bromouracil case study
-
Weitere Titelangaben:Marques et al.
-
Beteiligte:Marques, Telma S. ( Autor:in ) / Schürmann, Robin ( Autor:in ) / Ebel, Kenny ( Autor:in ) / Heck, Christian ( Autor:in ) / Śmiałek, Małgorzata A. ( Autor:in ) / Eden, Sam ( Autor:in ) / Mason, Nigel ( Autor:in ) / Bald, Ilko ( Autor:in )
-
Erschienen in:The Journal of Chemical Physics ; 152, 12 ; 8
-
Verlag:
- Neue Suche nach: AIP Publishing LLC
-
Erscheinungsdatum:31.03.2020
-
Format / Umfang:8 pages
-
ISSN:
-
DOI:
-
Medientyp:Aufsatz (Zeitschrift)
-
Format:Elektronische Ressource
-
Sprache:Englisch
-
Schlagwörter:
-
Datenquelle:
Inhaltsverzeichnis – Band 152, Ausgabe 12
Zeige alle Jahrgänge und Ausgaben
Die Inhaltsverzeichnisse werden automatisch erzeugt und basieren auf den im Index des TIB-Portals verfügbaren Einzelnachweisen der enthaltenen Beiträge. Die Anzeige der Inhaltsverzeichnisse kann daher unvollständig oder lückenhaft sein.
-
The size and affinity effect of counterions on self-assembly of charged block copolymersJiang, Jiadi / Chen, Xu / Yang, Shuang / Chen, Er-Qiang et al. | 2020
-
Quantum orbital-optimized unitary coupled cluster methods in the strongly correlated regime: Can quantum algorithms outperform their classical equivalents?Sokolov, Igor O. / Barkoutsos, Panagiotis Kl. / Ollitrault, Pauline J. / Greenberg, Donny / Rice, Julia / Pistoia, Marco / Tavernelli, Ivano et al. | 2020
-
Extended separated-pair approximation for transition metal potential energy curvesLi, Shuhang J. / Gagliardi, Laura / Truhlar, Donald G. et al. | 2020
-
Benzene–H2O and benzene–HDO: Fully coupled nine-dimensional quantum calculations of flexible H2O/HDO intramolecular vibrational excitations and intermolecular states of the dimers, and their infrared and Raman spectra using compact basesFelker, Peter M. / Bačić, Zlatko et al. | 2020
-
Adlayer growth vs spontaneous (near-) surface alloy formation: Zn growth on Au(111)Schüttler, Konstantin M. / Bansmann, Joachim / Engstfeld, Albert K. / Behm, R. Jürgen et al. | 2020
-
Changes in electronic structure of carbon supports for Pt catalysts induced by vacancy formation due to Ar+ irradiationOkazaki, Hiroyuki / Kakitani, Kenta / Kimata, Tetsuya / Idesaki, Akira / Koshikawa, Hiroshi / Matsumura, Daiju / Yamamoto, Shunya / Yamaki, Tetsuya et al. | 2020
-
Bond dissociation energies of diatomic transition metal selenides: ScSe, YSe, RuSe, OsSe, CoSe, RhSe, IrSe, and PtSeSorensen, Jason J. / Tieu, Erick / Morse, Michael D. et al. | 2020
-
Coherent phonon generation in laser-heated gold nanofilmWang, Xuan / Li, Junjie / Cao, Jianming et al. | 2020
-
Finding acceptable parameter regions of stochastic Hill functions for multisite phosphorylation mechanismChen, M. / Ahmadian, M. / Watson, L. T. / Cao, Y. et al. | 2020
-
Approximate equation-of-motion coupled-cluster methods for electron affinities of closed-shell moleculesMa, Fengjiao / Wang, Zhifan / Guo, Minggang / Wang, Fan et al. | 2020
-
Toward a quantitative analysis of the temperature dependence of electron attachment to SF6Poutsma, John C. / Shuman, Nicholas S. / Miller, Thomas M. / Troe, Jürgen / Viggiano, Albert A. et al. | 2020
-
Molecular polarizabilities as fingerprints of perturbations to water by ions and confinementRozsa, Viktor / Pham, Tuan Anh / Galli, Giulia et al. | 2020
-
Kinetics of molecular decomposition under irradiation of gold nanoparticles with nanosecond laser pulses—A 5-Bromouracil case studyMarques, Telma S. / Schürmann, Robin / Ebel, Kenny / Heck, Christian / Śmiałek, Małgorzata A. / Eden, Sam / Mason, Nigel / Bald, Ilko et al. | 2020
-
Potential energy shift of the Fermi level at plasmonic structures for light-energy conversion determined by graphene-based Raman measurementsMinamimoto, Hiro / Yasuda, Kensuke / Zhou, Ruifeng / Li, Xiaowei / Yasuda, Satoshi / Murakoshi, Kei et al. | 2020
-
Inexpensive modeling of quantum dynamics using path integral generalized Langevin equation thermostatsKapil, Venkat / Wilkins, David M. / Lan, Jinggang / Ceriotti, Michele et al. | 2020
-
Temperature expansions in the square-shoulder fluid. I. The Wiener–Hopf functionCoquand, O. / Sperl, M. et al. | 2020
-
Long-range interactions of the ground state muonium with atomsYang, H. / Wu, M.-S. / Tang, L.-Y. / Bromley, M. W. J. / Varga, K. / Yan, Z.-C. / Zhang, J.-Y. et al. | 2020
-
ABINIT: Overview and focus on selected capabilitiesRomero, Aldo H. / Allan, Douglas C. / Amadon, Bernard / Antonius, Gabriel / Applencourt, Thomas / Baguet, Lucas / Bieder, Jordan / Bottin, François / Bouchet, Johann / Bousquet, Eric et al. | 2020
-
Octopus, a computational framework for exploring light-driven phenomena and quantum dynamics in extended and finite systemsTancogne-Dejean, Nicolas / Oliveira, Micael J. T. / Andrade, Xavier / Appel, Heiko / Borca, Carlos H. / Le Breton, Guillaume / Buchholz, Florian / Castro, Alberto / Corni, Stefano / Correa, Alfredo A. et al. | 2020
-
Fabrication and functions of graphene–molecule–graphene single-molecule junctionsYang, Caiyao / Qin, Anjun / Tang, Ben Zhong / Guo, Xuefeng et al. | 2020
-
The many-body expansion approach to ab initio calculation of electric field gradients in molecular crystalsGregorovič, Alan et al. | 2020
-
Tailored energy level alignment at MoOX/GaP interface for solar-driven redox flow battery applicationBae, Dowon / Kanellos, Gerasimos / Wedege, Kristina / Dražević, Emil / Bentien, Anders / Smith, Wilson A. et al. | 2020
-
Constrained dipole moment density functional theory for charge distributions in force fields for the study of molecular fluidsCarmona-Espíndola, Javier / Núñez-Rojas, Edgar / García-Melgarejo, Valeria / Gázquez, José L. / Alejandre, José et al. | 2020
-
Can second order nonlinear spectroscopies selectively probe optically “dark” surface states in small semiconductor nanocrystals?Kelley, Anne Myers et al. | 2020
-
Theoretical analysis of electrode-dependent interfacial structures on hydrate-melt electrolytesTakenaka, Norio / Inagaki, Taichi / Shimada, Tatau / Yamada, Yuki / Nagaoka, Masataka / Yamada, Atsuo et al. | 2020
-
The Vanishing water/oil interface in the presence of antagonistic saltGlende, Gudrun / de Wijn, Astrid S. / Pousaneh, Faezeh et al. | 2020
-
Improved theoretical calculations for electron-impact ionization of DNA analogue moleculesAli, Esam / Chakraborty, H. S. / Madison, D. H. et al. | 2020
-
Time-dependent optimized coupled-cluster method for multielectron dynamics. II. A coupled electron-pair approximationPathak, Himadri / Sato, Takeshi / Ishikawa, Kenichi L. et al. | 2020
-
DFTB+, a software package for efficient approximate density functional theory based atomistic simulationsHourahine, B. / Aradi, B. / Blum, V. / Bonafé, F. / Buccheri, A. / Camacho, C. / Cevallos, C. / Deshaye, M. Y. / Dumitrică, T. / Dominguez, A. et al. | 2020
-
Coarse-graining of polyisoprene melts using inverse Monte Carlo and local density potentialsShahidi, Nobahar / Chazirakis, Antonis / Harmandaris, Vagelis / Doxastakis, Manolis et al. | 2020
-
Influence of 3d, 4d, and 5d dopants on the oxygen evolution reaction at -Fe2O3(0001) under dark and illumination conditionsHajiyani, Hamidreza / Pentcheva, Rossitza et al. | 2020
-
Efficient and automated computation of accurate molecular geometries using focal-point approximations to large-basis coupled-cluster theoryWarden, Constance E. / Smith, Daniel G. A. / Burns, Lori A. / Bozkaya, Uğur / Sherrill, C. David et al. | 2020
-
Measurement optimization in the variational quantum eigensolver using a minimum clique coverVerteletskyi, Vladyslav / Yen, Tzu-Ching / Izmaylov, Artur F. et al. | 2020
-
Theoretical study of kinetics of proton coupled electron transfer in photocatalysisGiret, Yvelin / Guo, Pu / Wang, Li-Feng / Cheng, Jun et al. | 2020
-
Insight into the interface between Fe3O4 (001) surface and water overlayers through multiscale molecular dynamics simulationsLiu, Hongsheng / Bianchetti, Enrico / Siani, Paulo / Di Valentin, Cristiana et al. | 2020
-
Role of shell composition and morphology in achieving single-emitter photostability for green-emitting “giant” quantum dotsMcBride, James R. / Mishra, Nimai / Click, Sophia M. / Orfield, Noah J. / Wang, Feng / Acharya, Krishna / Chisholm, Matthew F. / Htoon, Han / Rosenthal, Sandra J. / Hollingsworth, Jennifer A. et al. | 2020
-
Spin chemistryHore, P. J. / Ivanov, Konstantin L. / Wasielewski, Michael R. et al. | 2020
-
Multiple Auger decays of core-excited states in N2Odagiri, Takeshi / Taniguchi, Takuro / Kaneyasu, Tatsuo / Tanaka, Hirokazu / Adachi, Jun-ichi / Lablanquie, Pascal / Hikosaka, Yasumasa et al. | 2020
-
Reconciling computational and experimental trends in the temperature dependence of the interfacial mobility of polymer filmsZhang, Wengang / Starr, Francis W. / Douglas, Jack F. et al. | 2020
-
Inferring effective forces for Langevin dynamics using Gaussian processesBryan, J. Shepard / Sgouralis, Ioannis / Pressé, Steve et al. | 2020
-
ACE-Molecule: An open-source real-space quantum chemistry packageKang, Sungwoo / Woo, Jeheon / Kim, Jaewook / Kim, Hyeonsu / Kim, Yongjun / Lim, Jaechang / Choi, Sunghwan / Kim, Woo Youn et al. | 2020
-
Temperature expansions in the square-shoulder fluid. II. ThermodynamicsCoquand, O. / Sperl, M. et al. | 2020
-
Microcanonical rates from ring-polymer molecular dynamics: Direct-shooting, stationary-phase, and maximum-entropy approachesTao, Xuecheng / Shushkov, Philip / Miller, Thomas F. et al. | 2020