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Michael S. Schuurman
Michael S. Schuurman
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Toward subchemical accuracy in computational thermochemistry: Focal point analysis of the heat of formation of NCO and [H, N, C, O] isomers
MS Schuurman, SR Muir, WD Allen, HF Schaefer III
The Journal of chemical physics 120 (24), 11586-11599, 2004
3832004
Role of Rydberg states in the photochemical dynamics of ethylene
T Mori, WJ Glover, MS Schuurman, TJ Martinez
The Journal of Physical Chemistry A 116 (11), 2808-2818, 2012
1492012
Dynamics at conical intersections
MS Schuurman, A Stolow
Annual review of physical chemistry 69, 427-450, 2018
1472018
Tabletop imaging of structural evolutions in chemical reactions demonstrated for the acetylene cation
H Ibrahim, B Wales, S Beaulieu, BE Schmidt, N Thiré, EP Fowe, É Bisson, ...
Nature communications 5 (1), 4422, 2014
1382014
Sub-7-femtosecond conical-intersection dynamics probed at the carbon K-edge
KS Zinchenko, F Ardana-Lamas, I Seidu, SP Neville, J van der Veen, ...
Science 371 (6528), 489-494, 2021
1042021
Ultrafast x-ray spectroscopy of conical intersections
SP Neville, M Chergui, A Stolow, MS Schuurman
Physical review letters 120 (24), 243001, 2018
972018
Capturing roaming molecular fragments in real time
T Endo, SP Neville, V Wanie, S Beaulieu, C Qu, J Deschamps, ...
Science 370 (6520), 1072-1077, 2020
782020
The highly anharmonic BH5 potential energy surface characterized in the ab initio limit
MS Schuurman, WD Allen, P von Ragué Schleyer, HF Schaefer
The Journal of chemical physics 122 (10), 2005
752005
The ab initio limit quartic force field of BH3
MS Schuurman, WD Allen, HF Schaefer III
Journal of computational chemistry 26 (11), 1106-1112, 2005
642005
Beyond structure: ultrafast X-ray absorption spectroscopy as a probe of non-adiabatic wavepacket dynamics
SP Neville, V Averbukh, S Patchkovskii, M Ruberti, R Yun, M Chergui, ...
Faraday discussions 194, 117-145, 2016
612016
Ultrafast non-adiabatic dynamics of methyl substituted ethylenes: The π3s Rydberg state
G Wu, AE Boguslavskiy, O Schalk, MS Schuurman, A Stolow
The Journal of chemical physics 135 (16), 2011
582011
Through-bond interactions and the localization of excited-state dynamics
O Schalk, AE Boguslavskiy, A Stolow, MS Schuurman
Journal of the American Chemical Society 133 (41), 16451-16458, 2011
582011
Excited state non-adiabatic dynamics of the smallest polyene, trans 1, 3-butadiene. II. Ab initio multiple spawning simulations
WJ Glover, T Mori, MS Schuurman, AE Boguslavskiy, O Schalk, A Stolow, ...
The Journal of chemical physics 148 (16), 2018
572018
Internal conversion versus intersystem crossing: What drives the gas phase dynamics of cyclic α, β-enones?
O Schalk, MS Schuurman, G Wu, P Lang, M Mucke, R Feifel, A Stolow
The Journal of Physical Chemistry A 118 (12), 2279-2287, 2014
552014
Determining quasidiabatic coupled electronic state Hamiltonians using derivative couplings: A normal equations based method
BN Papas, MS Schuurman, DR Yarkony
The Journal of Chemical Physics 129 (12), 2008
552008
On the simulation of photoelectron spectra in molecules with conical intersections and spin-orbit coupling: The vibronic spectrum of CH3S
MS Schuurman, DE Weinberg, DR Yarkony
The Journal of chemical physics 127 (10), 2007
522007
On the vibronic coupling approximation: A generally applicable approach for determining fully quadratic quasidiabatic coupled electronic state Hamiltonians
MS Schuurman, DR Yarkony
The Journal of chemical physics 127 (9), 2007
462007
Excited state x-ray absorption spectroscopy: Probing both electronic and structural dynamics
SP Neville, V Averbukh, M Ruberti, R Yun, S Patchkovskii, M Chergui, ...
The Journal of Chemical Physics 145 (14), 2016
432016
Excited state non-adiabatic dynamics of the smallest polyene, trans 1, 3-butadiene. I. Time-resolved photoelectron-photoion coincidence spectroscopy
AE Boguslavskiy, O Schalk, N Gador, WJ Glover, T Mori, T Schultz, ...
The Journal of chemical physics 148 (16), 2018
422018
Substituent effects on dynamics at conical intersections: Allene and methyl allenes
SP Neville, Y Wang, AE Boguslavskiy, A Stolow, MS Schuurman
The Journal of chemical physics 144 (1), 2016
312016
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Artículos 1–20