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Barry Moore II
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Acid/base‐triggered switching of circularly polarized luminescence and electronic circular dichroism in organic and organometallic helicenes
N Saleh, B Moore, M Srebro, N Vanthuyne, L Toupet, JAG Williams, ...
Chemistry–A European Journal 21 (4), 1673-1681, 2015
1742015
Performance of an optimally tuned range-separated hybrid functional for 0–0 electronic excitation energies
D Jacquemin, B Moore, A Planchat, C Adamo, J Autschbach
Journal of Chemical Theory and Computation 10 (4), 1677-1685, 2014
1512014
Longest-wavelength electronic excitations of linear cyanines: the role of electron delocalization and of approximations in time-dependent density functional theory
B Moore, J Autschbach
Journal of chemical theory and computation 9 (11), 4991-5003, 2013
1172013
Charge-Transfer Versus Charge-Transfer-Like Excitations Revisited⊥
B Moore, H Sun, N Govind, K Kowalski, J Autschbach
Journal of chemical theory and computation 11 (7), 3305-3320, 2015
892015
Analysis of optical activity in terms of bonds and lone-pairs: the exceptionally large optical rotation of norbornenone
B Moore, M Srebro, J Autschbach
Journal of Chemical Theory and Computation 8 (11), 4336-4346, 2012
622012
Electronic band shapes calculated with optimally tuned range-separated hybrid functionals
B Moore, A Charaf-Eddin, A Planchat, C Adamo, J Autschbach, ...
Journal of Chemical Theory and Computation 10 (10), 4599-4608, 2014
452014
Ruthenium‐grafted vinylhelicenes: chiroptical properties and redox switching
M Srebro, E Anger, B Moore II, N Vanthuyne, C Roussel, R Réau, ...
Chemistry–A European Journal 21 (47), 17100-17115, 2015
402015
Ab initio study of circular dichroism and circularly polarized luminescence of spin-allowed and spin-forbidden transitions: from organic ketones to lanthanide complexes
F Gendron, B Moore II, O Cador, F Pointillart, J Autschbach, B Le Guennic
Journal of Chemical Theory and Computation 15 (7), 4140-4155, 2019
372019
Large‐Scale Synthesis of Helicene‐Like Molecules for the Design of Enantiopure Thin Films with Strong Chiroptical Activity
A Bensalah‐Ledoux, D Pitrat, T Reynaldo, M Srebro‐Hooper, B Moore, ...
Chemistry–A European Journal 22 (10), 3333-3346, 2016
292016
Density functional study of tetraphenylporphyrin long‐range exciton coupling
B Moore, J Autschbach
ChemistryOpen 1 (4), 184-194, 2012
282012
II; Srebro, M.; Autschbach, J. Analysis of optical activity in terms of bonds and lone-pairs: The exceptionally large optical rotation of norbornenone
B Moore
J. Chem. Theory Comput 8, 4336-4346, 2012
252012
Electronic π‐to‐π* Excitations of Rhodamine Dyes Exhibit a Time‐Dependent Kohn–Sham Theory “Cyanine Problem”
B Moore, RL Schrader, K Kowalski, J Autschbach
ChemistryOpen 6 (3), 385-392, 2017
212017
Iridium (III) complexes containing 1, 10-phenanthroline and derivatives: synthetic, stereochemical, and structural studies, and their antimicrobial activity
M Pandrala, F Li, L Wallace, PJ Steel, B Moore II, J Autschbach, ...
Australian Journal of Chemistry 66 (9), 1065-1073, 2013
192013
II, N. Vanthuyne, C. Roussel, R. Réau, J. Autschbach, J. Crassous
M Srebro, E Anger, B Moore
Chem. Eur. J 21, 17100-17115, 2015
82015
II; Planchat, A.; Adamo, C.; Autschbach, J
D Jacquemin, B Moore
Performance of an Optimally Tuned Range-Separated Hybrid Functional for 0–0 …, 2014
62014
II; Autschbach, J.; Collins, JG; Keene, FR
M Pandrala, F Li, L Wallace, PJ Steel, B Moore
Aust. J. Chem 66, 1065-1073, 2013
52013
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