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7344 results: 7284 articles and 60 books or book chapters
Last updated: Sep 10, 2026-
4701
Electronic Structure of Ni2E2 Complexes (E = S, Se, Te) and a Global
Analysis of M2E2 Compounds: A Case for Quantized E-2(n-) Oxidation
Levels with n=2, 3, or 4
S. A. Yao, V. Martin-Diaconescu, I. Infante, K. M. Lancaster, A. W. Goetz, S. DeBeer, and J. F. Berry
J. Am. Chem. Soc. 137, 4993 (2015). -
4702
Sulfur-Bridged Terthiophene Dimers: How Sulfur Oxidation State Controls
Interchromophore Electronic Coupling
C. D. Cruz, P. R. Christensen, E. L. Chronister, D. Casanova, M. O. Wolf, and C. J. Bardeen
J. Am. Chem. Soc. 137, 12552 (2015). -
4703
``Darker-than-Black'' PbS Quantum Dots: Enhancing Optical Absorption
of Colloidal Semiconductor Nanocrystals via Short Conjugated Ligands
C. Giansante, I. Infante, E. Fabiano, R. Grisorio, G. P. Suranna, and G. Gigli
J. Am. Chem. Soc. 137, 1875 (2015). -
4704
Tunable surface plasmon instability leading to emission of radiation
G. Gumbs, A. Iurov, D. Huang, and W. Pan
J. Appl. Phys. 118, 054303 (2015). -
4705
Fluorinated networks dynamics studied by means of broadband dielectric
spectroscopy
L. A. Miccio, J. Otegui, M. E. Penoff, P. E. Montemartini, and G. A. Schwartz
J. Appl. Polym. Sci. 132, 42690 (2015). -
4706
Dynamics of tetrahydrofuran as minority component in a mixture with
poly(2-(dimethylamino)ethyl methacrylate): A neutron scattering and
dielectric spectroscopy investigation
G. Goracci, A. Arbe, A. Alegria, W. Lohstroh, Y. Su, and J. Colmenero
J. Chem. Phys. 143, 094505 (2015). -
4707
Vibrational dynamics and band structure of methyl-terminated Ge(111)
Z. M. Hund, K. J. Nihill, D. Campi, K. T. Wong, N. S. Lewis, M. Bernasconi, G. Benedek, and S. J. Sibener
J. Chem. Phys. 143, 124705 (2015). -
4708
Quantifying charge resonance and multiexciton character in coupled
chromophores by charge and spin cumulant analysis
A. V. Luzanov, D. Casanova, X. Feng, and A. I. Krylov
J. Chem. Phys. 142, 224104 (2015). -
4709
H-4: A challenging system for natural orbital functional approximations
E. Ramos-Cordoba, X. Lopez, M. Piris, and E. Matito
J. Chem. Phys. 143, 164112 (2015). -
4710
Influence of the van der Waals interaction in the dissociation dynamics
of N-2 on W(110) from first principles
L. Martin-Gondre, J. I. Juaristi, M. Blanco-Rey, R. Diez Muino, and M. Alducin
J. Chem. Phys. 142, 074704 (2015). -
4711
Robust validation of approximate 1-matrix functionals with few-electron
harmonium atoms
J. Cioslowski, M. Piris, and E. Matito
J. Chem. Phys. 143, 214101 (2015). -
4712
Dielectric relaxation of 2-ethyl-1-hexanol around the glass transition
by thermally stimulated depolarization currents
S. Arrese-Igor, A. Alegria, and J. Colmenero
J. Chem. Phys. 142, 214504 (2015). -
4713
Orbitals from local RDMFT: Are they Kohn-Sham or natural orbitals?
I. Theophilou, N. N. Lathiotakis, N. I. Gidopoulos, A. Rubio, and N. Helbig
J. Chem. Phys. 143, 054106 (2015). -
4714
Diffusion of hydrogen interstitials in the near-surface region of
Pd(111) under the influence of surface coverage and external static
electric fields
M. Blanco-Rey, and J. C. Tremblay
J. Chem. Phys. 142, 154704 (2015). -
4715
Bright Fission: Singlet Fission into a Pair of Emitting States
D. Casanova
J. Chem. Theory Comput. 11, 2642 (2015). -
4716
Quasiparticle Interfacial Level Alignment of Highly Hybridized Frontier
Levels: H2O on TiO2(110)
A. Migani, D. J. Mowbray, J. Zhao, and H. Petek
J. Chem. Theory Comput. 11, 239 (2015). -
4717
Effect of addition of silica- and amine functionalized
silica-nanoparticles on the microstructure of calcium silicate hydrate
(C-S-H) gel
M. Monasterio, J. J. Gaitero, E. Erkizia, A. M. Guerrero Bustos, L. A. Miccio, J. S. Dolado, and S. Cerveny
J. Colloid Interface Sci. 450, 109 (2015). -
4718
A Hierarchical Algorithm for Molecular Similarity (H-FORMS)
A. Ramirez-Manzanares, J. Pena, J. M. Azpiroz, and G. Merino
J. Comput. Chem. 36, 1456 (2015). -
4719
Multiple-time-stepping generalized hybrid Monte Carlo methods
B. Escribano, E. Akhmatskaya, S. Reich, and J. M. Azpiroz
J. Comput. Phys. 280, 1 (2015). -
4720
Dichroism in the photoionisation of atoms at XUV free-electron lasers
T. Mazza, E. V. Gryzlova, A. N. Grum-Grzhimailo, A. K. Kazansky, N. M. Kabachnik, and M. Meyer
J. Electron Spectrosc. Relat. Phenom. 204, 313 (2015).