Identification of a new electron-transfer relaxation pathway in photoexcited pyrrole dimers
Simon P. Neville, Oliver M. Kirkby, Nikolas Kaltsoyannis et al. · Nature Communications · 2016
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132 papers2 with full textQuestions on this topic
Complexes Between Adamantane Analogues B 4 X 6 -X = {CH 2 , NH, O; SiH 2 , PH, S} - and Dihydrogen, B 4 X 6 : n H 2 ( n = 1–4)
Josep M. Oliva-Enrich, Ibon Alkorta, José Elguero · Molecules · 2020
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Description of the Chemical Reaction Path in the HCO Molecule: A Combined Configuration Interaction and Tight-Binding Approach
N. C. Bacalis, A. Metropoulos, D. A. Papaconstantopoulos · 2004
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Anisotropic Local Stress and Particle Hopping in a Deeply Supercooled Liquid
Sarika Bhattacharyya, Biman Bagchi · Phys. Rev. Lett, volume 89, page 025504-1, (2002) · 2005
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First-Passage Time: A Conception Leading to Superstatistics. II. Continuous Distributions and their Applications
V. V. Ryazanov · 2006
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Dynamics of Chemical Reactions: Open Equilibrium
B. Zilbergleyt · 2000
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Le Chatelier Response
B. Zilbergleyt · 2005
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GRECP/MRD-CI calculations of the spin-orbit splitting in the ground state of Tl and of the spectroscopic properties of TlH
A. V. Titov, N. S. Mosyagin, A. B. Alekseyev et al. · 2000
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Trial function optimization for excited states of van der Waals clusters
M. P. Nightingale, Vilen Melik-Alaverdian · 2001
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Algebraic Models: Coordinates, Scales, and Dynamical Symmetries
Michael W. N. Ibrahim · 2000
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GRECP/RCC calculation of the spectroscopic constants for the HgH molecule and its cation
N. Mosyagin, A. Titov, E. Eliav et al. · 2001
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Design and Test of a Carbon-Tolerant Alkaline Fuel Cell
Mirna Urquidi-Macdonald, Ayusman Sen, Patrick Grimes et al. · 2005
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An estimate of the inter-system crossing time in light-emitting polymers
William Barford, Eric E. Moore · 2004
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Heats of formation of perchloric acid, HClO$_4$, and perchloric anhydride, Cl$_2$O$_7$. Probing the limits of W1 and W2 theory
Jan M. L. Martin · J. Mol. Struct. (THEOCHEM) 771, 19-26 (2006) · 2005
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Comments on "Effective Core Potentials" [M.Dolg, Modern Methods and Algorithms of Quantum Chemistry (Ed. by J.Grotendorst, John von Neumann Institute for Computing, Jülich, NIC Series, Vol.1, ISBN 3-00-005618-1, pp.479-508, 2000)]
A. V. Titov, N. S. Mosyagin · 2000
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Some Aspects of Dynamical Tunneling in Two Dimensional Coupled States
Dmytro Babyuk · 2002
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Ortho-Para Conversion in CH3F. Self-Consistent Theoretical Model
Pavel L. Chapovsky · Appl. Magn. Reson. v.18, 363-374 (2000) · 2000
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Molecular Realism in Default Models for Information Theories of Hydrophobic Effects
M. A. Gomez, L. R. Pratt, G. Hummer et al. · 1999
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Electrophilicity as a Possible Descriptor of the Kinetic Behaviour
P. K. Chattaraj, U. Sarkar, M. Elango et al. · 2005
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Application of time-dependent density-functional theory to electron-ion couplng in ethylene
G. F. Bertsch, J. Giansiracusa, K. Yabana · Israel Journal of Chemistry 42 151 (2002) · 2003
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