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7344 results: 7284 articles and 60 books or book chapters
Last updated: Sep 10, 2026-
3841
Alkaloids reactivity: DFT analysis of selective demethylation reactions
O. Larranaga, J. I. Miranda, F. P. Cossio, and A. de Cozar
J. Org. Chem. 83, 15101 (2018). -
3842
Synthesis of exo-Imidazolidin-2-one Dienes, Their Isomerization, and
Selectivity in Diels-Alder Cycloadditions
C. Espinoza-Hicks, P. Montoya, R. Bautista, H. A. Jimenez-Vazquez, L. M. Rodriguez-Valdez, A. A. Camacho-Davila, F. P. Cossio, F. Delgado, and J. Tamariz
J. Org. Chem. 83, 5347 (2018). -
3843
Revised Theoretical Model on Enantiocontrol in Phosphoric Acid Catalyzed
H-Transfer Hydrogenation of Quinoline
J. Pastor, E. Rezabal, A. Voituriez, J. -F. Betzer, A. Marinetti, and G. Frison
J. Org. Chem. 83, 2779 (2018). -
3844
1,3-Dioxa-[3,3]-sigmatropic Oxo-Rearrangement of Substituted Allylic
Carbamates: Scope and Mechanistic Studies
M. Agirre, S. Henrion, I. Rivilla, J. I. Miranda, F. P. Cossio, B. Carboni, , J. M. Villalgordo, and F. Carreaux
J. Org. Chem. 83, 14861 (2018). -
3845
A Definition of the Magnetic Transition Temperature Using Valence Bond
Theory
J. Jornet-Somoza, M. Deumal, J. Borge, and M. A. Robb
J. Phys. Chem. A 122, 2168 (2018). -
3846
Comparison of Electron and Ion Emission from Xenon Cluster-Induced
Ignition of Helium Nanodroplets
M. Kelbg, A. Heidenreich, L. Kazak, M. Zabel, B. Krebs, K. -H. Meiwes-Broer, and J. Tiggesbaeumker
J. Phys. Chem. A 122, 8107 (2018). -
3847
Electron-Pair Distribution in Chemical Bond Formation
M. Rodriguez-Mayorga, M. Via-Nadal, M. Sola, J. M. Ugalde, X. Lopez, and E. Matito
J. Phys. Chem. A 122, 1916+ (2018). -
3848
Density Functional Theory Study on the Demethylation Reaction between
Methylamine, Dimethylamine, Trimethylamine, and Tamoxifen Catalyzed by a
Fe(IV)-Oxo Porphyrin Complex
N. Alberro, M. Torrent-Sucarrat, A. Arrieta, G. Rubiales, and F. P. Cossio
J. Phys. Chem. A 122, 1658 (2018). -
3849
Oxidation of Acid, Base, and Amide Side-Chain Amino Acid Derivatives via
Hydroxyl Radical
J. Uranga, J. I. Mujika, R. Grande-Aztatzi, and J. M. Matxain
J. Phys. Chem. B 122, 4956 (2018). -
3850
Instrumental Effects in the Dynamics of an Ultrafast Folding Protein
under Mechanical Force
D. De Sancho, J. Schonfelder, R. B. Best, R. Perez-Jimenez, and V. Munoz
J. Phys. Chem. B 122, 11147 (2018). -
3851
Density Functional Theory Modeling of Solid-State Nuclear Magnetic
Resonances for Polycyclic Aromatic Hydrocarbons
V. Diez-Gomez, I. Sobrados, J. Sanz, M. Carrera, A. Guijarro, J. A. Verges, and P. L. de Andres
J. Phys. Chem. C 122, 11008 (2018). -
3852
Effect of Structural Fluctuations on Elastic Lifetimes of Adsorbate
States: Isonicotinic Acid on Rutile(110)
M. Mueller, D. Sanchez-Portal, H. Lin, G. P. Brivio, A. Selloni, and G. Fratesi
J. Phys. Chem. C 122, 7575 (2018). -
3853
Nonmetallic FeH6 under High Pressure
S. Zhang, J. Lin, Y. Wang, G. Yang, A. Bergara, and Y. Ma
J. Phys. Chem. C 122, 12022 (2018). -
3854
Multicenter Bonding Effects in Oxygen Vacancy in the Bulk and on the
Surface of MgO
I. A. Popov, E. Jimenez-Izal, A. N. Alexandrova, and A. I. Boldyrev
J. Phys. Chem. C 122, 11933 (2018). -
3855
Tracing Polymerization in Calcium Silicate Hydrates Using Si Isotopic
Fractionation
R. Dupuis, J. S. Dolado, J. Surga, and A. Ayuela
J. Phys. Chem. C 122, 8356 (2018). -
3856
Magnetic-State Controlled Molecular Vibrational Dynamics at Buried
Molecular-Metal Interfaces
I. Martinez, J. P. Cascales, C. Gonzalez-Ruano, J. -Y. Hong, C. -F. Hung, M. -T. Lin, T. Frederiksen, and F. G. Aliev
J. Phys. Chem. C 122, 26499 (2018). -
3857
Electron-Phonon Interaction in the 4/3-Monolayer of Pb on Si(111):
Theory Versus He-Atom Scattering Experiments
I. Y. Sklyadneva, G. Benedek, R. Heid, P. M. Echenique, J. P. Toennies, and E. V. Chulkov
J. Phys. Chem. C 122, 29039 (2018). -
3858
Electronic Properties of Substitutionally Boron-Doped Graphene
Nanoribbons on a Au(111) Surface
E. Carbonell-Sanroma, A. Garcia-Lekue, M. Corso, G. Vasseur, P. Brandimarte, J. Lobo-Checa, D. G. de Oteyza, J. Li, S. Kawai, S. Saito, S. Yamaguchi, J. Enrique Ortega, D. Sanchez-Portal, and J. Ignacio Pascual
J. Phys. Chem. C 122, 16092 (2018). -
3859
Switching from Reactant to Substrate Engineering in the Selective
Synthesis of Graphene Nanoribbons
N. Merino-Diez, J. Lobo-Checa, P. Nita, A. Garcia-Lekue, A. Basagni, G. Vasseur, F. Tiso, F. Sedona, P. K. Das, J. Fujii, I. Vobornik, M. Sambi, J. Ignacio Pascual, J. Enrique Ortega, and D. G. de Oteyza
J. Phys. Chem. Lett. 9, 2510 (2018). -
3860
Room-Temperature Optical Picocavities below 1 nm(3) Accessing
Single-Atom Geometries
C. Carnegie, J. Griffiths, B. de Nijs, C. Readman, R. Chikkaraddy, W. M. Deacon, Y. Zhang, I. Szabo, E. Rosta, J. Aizpurua, and J. J. Baumberg
J. Phys. Chem. Lett. 9, 7146 (2018).