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7344 results: 7284 articles and 60 books or book chapters
Last updated: Sep 10, 2026-
4141
From tunneling to contact in a magnetic atom: The non-equilibrium Kondo
effect
D. -J. Choi, P. Abufager, L. Limot, and N. Lorente
J. Chem. Phys. 146, 092309 (2017). -
4142
Analytic gradients for natural orbital functional theory
I. Mitxelena, and M. Piris
J. Chem. Phys. 146, 014102 (2017). -
4143
Communication: Hot-atom abstraction dynamics of hydrogen from tungsten
surfaces: The role of surface structure
O. Galparsoro, H. F. Busnengo, J. Inaki Juaristi, C. Crespos, M. Alducin, and P. Larregaray
J. Chem. Phys. 147, 121103 (2017). -
4144
On the tautomerisation of porphycene on copper (111): Finding the subtlebalance between van der Waals interactions and hybridisation (vol 145,244701, 2016)
D. Novko, J. C. Tremblay, and M. Blanco-Rey
J. Chem. Phys. 147, 169901 (2017). -
4145
Complex nonequilibrium dynamics of stacked polystyrene films deep in the
glassy state
V. M. Boucher, D. Cangialosi, A. Alegria, and J. Colmenero
J. Chem. Phys. 146, 203312 (2017). -
4146
Simulations of water nano-confined between corrugated planes
J. Zubeltzu, and E. Artacho
J. Chem. Phys. 147, 194509 (2017). -
4147
Local Descriptors of Dynamic and Nondynamic Correlation
E. Ramos-Cordoba, and E. Matito
J. Chem. Theory Comput. 13, 2705 (2017). -
4148
Relevance of the DFT method to study expanded porphyrins with different
topologies
M. Torrent-Sucarrat, S. Navarro, F. P. Cossio, J. M. Anglada, and J. M. Luis
J. Comput. Chem. 38, 2819 (2017). -
4149
Designing 3D topological insulators by 2D-Xene (X = Ge, Sn) sheet
functionalization in GaGeTe-type structures
F. Pielnhofer, T. V. Menshchikova, I. P. Rusinov, A. Zeugner, I. Y. Sklyadneva, R. Heid, K. -P. Bohnen, P. Golub, A. I. Baranov, E. V. Chulkov, A. Pfitzner, M. Ruck, and A. Isaeva
J. Mater. Chem. C 5, 4752 (2017). -
4150
Dual emission and multi-stimuli-response in iridium(III) complexes with
aggregation-induced enhanced emission: applications for quantitative CO2
detection
C. Climent, P. Alam, S. S. Pasha, G. Kaur, A. R. Choudhury, I. R. Laskar, P. Alemany, and D. Casanova
J. Mater. Chem. C 5, 7784 (2017). -
4151
Transient and Stable Profiles During Anisotropic Wet Etching of Quartz
Y. Xing, M. A. Gosalvez, H. Zhang, Y. Li, and X. Qiu
J. Microelectromech. Syst. 26, 1063 (2017). -
4152
Charging dynamics of dopants in helium nanoplasmas
A. Heidenreich, B. Gruener, D. Schomas, F. Stienkemeier, S. R. Krishnan, and M. Mudrich
J. Mod. Opt. 64, 1061 (2017). -
4153
Exchange and correlation energies in silicene illuminated by circularly
polarized light
A. Iurov, G. Gumbs, and D. Huang
J. Mod. Opt. 64, 913 (2017). -
4154
Angular streaking and sideband formation in rotating terahertz and
far-infrared fields
A. K. Kazansky, I. P. Sazhina, V. L. Nosik, and N. M. Kabachnik
J. Phys. B-At. Mol. Opt. Phys. 50, 105601 (2017). -
4155
Dopant-induced ignition of helium nanoplasmas-a mechanistic study
A. Heidenreich, D. Schomas, and M. Mudrich
J. Phys. B-At. Mol. Opt. Phys. 50, 244001 (2017). -
4156
Ground- and excited-state scattering potentials for the stopping of
protons in an electron gas
F. Matias, R. C. Fadanelli, P. L. Grande, N. E. Koval, R. Diez Muino, A. G. Borisov, N. R. Arista, and G. Schiwietz
J. Phys. B-At. Mol. Opt. Phys. 50, 185201 (2017). -
4157
The trans Effect in Palladium Phosphine Sulfonate Complexes
E. Rezabal, J. M. Ugalde, and G. Frenking
J. Phys. Chem. A 121, 7709 (2017). -
4158
X-ray Emission Spectrum of Liquid Ethanol: Origin of Split Peaks
O. Takahashi, M. P. Ljungberg, and L. G. M. Pettersson
J. Phys. Chem. B 121, 11163 (2017). -
4159
Unveiling the Catalytic Role of B-Block Histidine in the N-S Acyl Shift
Step of Protein Splicing
J. I. Mujika, and X. Lopez
J. Phys. Chem. B 121, 7786 (2017). -
4160
On-surface synthesis of a pure and long-range-ordered titanium(IV)-porphyrin contact layer on titanium dioxide
G. Lovat, D. Forrer, M. Abadia, M. Dominguez, M. Casarin, C. Rogero, A. Vittadini, and L. Floreano
J. Phys. Chem. C 121, 13738 (2017).