Search Results - "Buma, W. J"
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Red spectral shift and enhanced quantum efficiency in phonon-free photoluminescence from silicon nanocrystals
Published in Nature nanotechnology (01-12-2010)“…Crystalline silicon is the most important semiconductor material in the electronics industry. However, silicon has poor optical properties because of its…”
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2
Controlling forward and backward rotary molecular motion on demand
Published in Nature communications (19-04-2022)“…Synthetic molecular machines hold tremendous potential to revolutionize chemical and materials sciences. Their autonomous motion controlled by external stimuli…”
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3
Use of Density Functional Based Tight Binding Methods in Vibrational Circular Dichroism
Published in The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory (13-12-2018)“…Vibrational circular dichroism (VCD) is a spectroscopic technique used to resolve the absolute configuration of chiral systems. Obtaining a theoretical VCD…”
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4
Frequency Range Selection Method for Vibrational Spectra
Published in The journal of physical chemistry letters (06-12-2018)“…Theoretical calculations of vibrational properties are widely used to explain and predict experimental spectra. However, with standard quantum chemical methods…”
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5
Proton transfer with a twist? Femtosecond Dynamics of 7-(2-pyridyl)indole in Condensed Phase and in Supersonic Jets
Published in Angewandte Chemie (International ed.) (28-07-2008)“…Twist‐assisted proton transfer: Excited‐state intramolecular proton transfer (ESIPT) in 7‐(2‐pyridyl)indole proceeds in a barrierless fashion and is coupled…”
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Infrared Spectroscopy of Jet-cooled “GrandPAHs” in the 3–100 μm Region
Published in The Astrophysical journal (01-12-2021)“…Abstract Although large polycyclic aromatic hydrocarbons (PAHs) are likely to be responsible for IR emission of gaseous and dusty regions, their neutral…”
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Isolated Building Blocks of Photonic Materials: High-Resolution Spectroscopy of Excited States of Jet-Cooled Push-Pull Stilbenes
Published in The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory (21-03-2002)“…The lowest excited singlet states of 4-(dimethylamino)-4‘-cyanostilbene (DCS), 4-(dimethylamino)-4‘-nitrostilbene (DANS), and…”
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Isolated Building Blocks of Photonic Materials: High-Resolution Excited-State Photoelectron Spectroscopy of Jet-Cooled Tetramethylethylene and 1,1‘-Bicyclohexylidene
Published in The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory (30-05-2002)“…The spectroscopy and photophysics of tetramethylethylene and 1,1‘-bicyclohexylidene have been investigated using excited-state photoelectron spectroscopy in…”
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9
Self-trapped exciton state in Si nanocrystals revealed by induced absorption
Published in Physical review. B, Condensed matter and materials physics (25-04-2012)“…We report results of time-resolved induced absorption (IA) spectroscopy on Si nanocrystals (Si NCs) embedded in a SiO sub(2) matrix. In line with theoretical…”
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10
Direct bandgap optical transitions in Si nanocrystals
Published in JETP letters (01-12-2010)“…The effect of quantum confinement on the direct bandgap of spherical Si nanocrystals has been modelled theoretically. We conclude that the energy of the direct…”
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High-Resolution Excited-State Photoelectron Spectroscopy of the Lower Rydberg States of Jet-Cooled C2H4 and C2D4
Published in The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory (18-04-2002)“…High-resolution (2+1) resonance-enhanced excited-state photoelectron spectroscopy on supersonic jet expansions of pure C2H4 and C2D4 has been employed to…”
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12
Two Ground State Conformers of the Proton Sponge 1,8-Bis(dimethylamino)naphthalene Revealed by Fluorescence Spectroscopy and ab Initio Calculations
Published in Journal of the American Chemical Society (20-05-1998)“…The S1 ↔ S0 transitions of the “proton sponge” 1,8-bis(dimethylamino)naphthalene have been studied by experiment and ab initio calculations. Fluorescence…”
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Photolysis-induced scrambling of PAHs as a mechanism for deuterium storage
Published 27-01-2020“…Aim. We investigate the role of PAHs as a sink for deuterium in the interstellar medium and study UV photolysis as a potential process in the variations of the…”
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Anharmonicity in the mid-infrared spectra of polycyclic aromatic hydrocarbons: Molecular beam spectroscopy and calculations
Published 22-07-2019“…Aims. In this work we determine the effects of anharmonicity on the mid-infrared spectra of the linear polycyclic aromatic hydrocarbons (PAHs) naphthalene,…”
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The asymmetric nature of charge transfer states of the cyano-substituted proton sponge
Published in Chemical physics letters (2005)“…The geometric and electronic structure of 1,8-bis(dimethylamino)-4-cyano-naphthalene (DMAN-CN) and its mono-protonated cation (H +DMAN-CN) have been…”
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16
Transient two-dimensional vibrational spectroscopy of an operating molecular machine
Published in Nature communications (20-12-2017)“…Synthetic molecular machines are promising building blocks for future nanoscopic devices. However, the details of their mechanical behaviour are in many cases…”
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Structure and Photophysics of an Old, New Molecule: 1,3,6,8-Tetraazatricyclo[4.4.1.13,8]dodecane
Published in Journal of the American Chemical Society (09-01-2002)“…More than a century after its initial synthesis, the static and dynamic geometry of 1,3,6,8-tetraazatricyclo [4.4.1.13,8]dodecane (TTD), a fully saturated…”
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High-resolution IR absorption spectroscopy of polycyclic aromatic hydrocarbons in the 3 micron region: role of hydrogenation and alkylation
Published 05-02-2018“…Aims. We aim to elucidate the spectral changes in the 3 micron region that result from chemical changes in the molecular periphery of polycyclic aromatic…”
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Resonance enhanced multiphoton ionization photoelectron spectroscopy of gerade excited Rydberg states of the xenon dimer
Published in Journal of electron spectroscopy and related phenomena (01-12-1998)“…Resonance enhanced multiphoton ionization with high-resolution kinetic-energy-resolved electron detection and with zero-kinetic-energy electron detection…”
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Ab initio calculations on vibronic coupling in the lower triplet states of pyrimidine
Published in Journal of the American Chemical Society (01-11-1992)Get full text
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