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7128 results: 7085 articles and 43 books or book chapters
Last updated: 2026/04/23-
4461
The boron-boron triple bond in NHC -> B equivalent to B <- NHC
N. Holzmann, M. Hermann, and G. Frenking
Chem. Sci. 6, 4089 (2015). -
4462
Recent developments and future prospects of all-metal aromatic compounds
J. M. Mercero, A. I. Boldyrev, G. Merino, and J. M. Ugalde
Chem. Soc. Rev. 44, 6519 (2015). -
4463
Reaction Mechanism of the Symmetry-Forbidden [2+2] Addition of
Ethylene and Acetylene to Amido-Substituted Digermynes and Distannynes
Ph2N-EE-NPh2, (E=Ge, Sn): A Theoretical Study
L. Zhao, C. Jones, and G. Frenking
Chem.-Eur. J. 21, 12405 (2015). -
4464
The Electronic Structure of the Al-3(-) Anion: Is it Aromatic?
J. M. Mercero, E. Matito, F. Ruiperez, I. Infante, X. Lopez, and J. M. Ugalde
Chem.-Eur. J. 21, 9610 (2015). -
4465
Microwave-Assisted Organocatalyzed Rearrangement of Propargyl Vinyl
Ethers to Salicylaldehyde Derivatives: An Experimental and Theoretical
Study
D. Tejedor, L. Cotos, D. Marquez-Arce, M. Odriozola-Gimeno, M. Torrent-Sucarrat, F. P. Cossio, and F. Garcia-Tellado
Chem.-Eur. J. 21, 18280 (2015). -
4466
Chemical Bonding of Transition-Metal Co-13 Clusters with Graphene
T. Alonso-Lanza, A. Ayuela, and F. Aguilera-Granja
ChemPhysChem 16, 3700 (2015). -
4467
pi-Hole Bonds: Boron and Aluminum Lewis Acid Centers
S. J. Grabowski
ChemPhysChem 16, 1470 (2015). -
4468
Lewis acid-Lewis base interactions: From NFH3+center dot center dot
center dot NCH and NF4+center dot center dot center dot NCH complexes to
NFH3+center dot center dot center dot(NCH)(n) and NF4+center dot center
dot center dot(NCH)(n) clusters
S. J. Grabowski
Comput. Theor. Chem. 1053, 289 (2015). -
4469
Assessment of Density-Functional Tight-Binding Ionization Potentials and
Electron Affinities of Molecules of Interest for Organic Solar Cells
Against First-Principles GW Calculations
A. A. M. H. M. Darghouth, M. E. Casida, W. Taouali, K. Alimi, M. P. Ljungberg, P. Koval, D. Sanchez-Portal, and D. Foerster
Computation 3, 616 (2015). -
4470
Design and performance characterization of electronic structure
calculations on massively parallel supercomputers: a case study of GPAW
on the Blue Gene/P architecture
N. A. Romero, C. Glinsvad, A. H. Larsen, J. Enkovaara, S. Shende, V. A. Morozov, and J. J. Mortensen
Concurr. Comput.-Pract. Exp. 27, 69 (2015). -
4471
Molecular simulation of oligo-glutamates in a calcium-rich aqueous
solution: insights into peptide-induced polymorph selection
J. Kahlen, C. Peter, and D. Donadio
Crystengcomm 17, 6863 (2015). -
4472
Redox-active and DNA-binding coordination complexes of clotrimazole
S. Betanzos-Lara, N. P. Chmel, M. T. Zimmerman, L. R. Barron-Sosa, C. Garino, L. Salassa, A. Rodger, J. L. Brumaghim, I. Gracia-Mora, and N. Barba-Behrens
Dalton Trans. 44, 3673 (2015). -
4473
Mesoscopic Josephson junctions with switchable current-phase relation
E. Strambini, F. S. Bergeret, and F. Giazotto
EPL 112, 17013 (2015). -
4474
Theory of diffusive phi(0) Josephson junctions in the presence of
spin-orbit coupling
F. S. Bergeret, and I. V. Tokatly
EPL 110, 57005 (2015). -
4475
Defect migration in methylammonium lead iodide and its role in
perovskite solar cell operation
J. M. Azpiroz, E. Mosconi, J. Bisquert, and F. De Angelis
Energy Environ. Sci. 8, 2118 (2015). -
4476
Remote Substituent Effects on the Stereoselectivity and Organocatalytic
Activity of Densely Substituted Unnatural Proline Esters in Aldol
Reactions
M. de Gracia Retamosa, A. de Cozar, M. Sanchez, J. I. Miranda, J. M. Sansano, L. M. Castello, C. Najera, A. I. Jimenez, F. J. Sayago, C. Cativiela, and F. P. Cossio
Eur. J. Org. Chem. 2015, 2503 (2015). -
4477
Synthesis of Chromen[4,3-b]pyrrolidines by Intramolecular 1,3-Dipolar
Cycloadditions of Azomethine Ylides: An Experimental and Computational
Assessment of the Origin of Stereocontrol
P. R. R. Costa, J. M. Sansano, U. Cossio, J. C. F. Barcellos, A. G. Dias, C. Najera, A. Arrieta, A. de Cozar, and F. P. Cossio
Eur. J. Org. Chem. 2015, 4689 (2015). -
4478
Enhancing and controlling single-atom high-harmonic generation spectra:
a time-dependent density-functional scheme
A. Castro, A. Rubio, and E. K. U. Gross
Eur. Phys. J. B 88, 191 (2015). -
4479
Modeling electron dynamics coupled to continuum states in finite volumes
with absorbing boundaries
U. De Giovannini, A. Hjorth Larsen, and A. Rubio
Eur. Phys. J. B 88, 56 (2015). -
4480
Zwitterionic ring-opening polymerization for the facile, efficient and
versatile grafting of functional polyethers onto graphene sheets
I. Asenjo-Sanz, J. I. Santos, A. M. Bittner, J. A. Pomposo, and F. Barroso-Bujans
Eur. Polym. J. 73, 413 (2015).