Detalhe da pesquisa
1.
Detection of electron tunneling across plasmonic nanoparticle-film junctions using nitrile vibrations.
Phys Chem Chem Phys
; 19(8): 5786-5796, 2017 Feb 22.
Artigo
em Inglês
| MEDLINE | ID: mdl-28180214
2.
Feynman's clock, a new variational principle, and parallel-in-time quantum dynamics.
Proc Natl Acad Sci U S A
; 110(41): E3901-9, 2013 Oct 08.
Artigo
em Inglês
| MEDLINE | ID: mdl-24062428
3.
Exciton coherence lifetimes from electronic structure.
J Chem Phys
; 136(10): 104510, 2012 Mar 14.
Artigo
em Inglês
| MEDLINE | ID: mdl-22423851
4.
A correlated-polaron electronic propagator: open electronic dynamics beyond the Born-Oppenheimer approximation.
J Chem Phys
; 137(22): 22A547, 2012 Dec 14.
Artigo
em Inglês
| MEDLINE | ID: mdl-23249084
5.
Benchmark results for empirical post-GGA functionals: difficult exchange problems and independent tests.
Phys Chem Chem Phys
; 13(43): 19325-37, 2011 Nov 21.
Artigo
em Inglês
| MEDLINE | ID: mdl-21956624
6.
The formulation and performance of a perturbative correction to the perfect quadruples model.
J Chem Phys
; 134(15): 154112, 2011 Apr 21.
Artigo
em Inglês
| MEDLINE | ID: mdl-21513380
7.
A tractable and accurate electronic structure method for static correlations: the perfect hextuples model.
J Chem Phys
; 133(2): 024103, 2010 Jul 14.
Artigo
em Inglês
| MEDLINE | ID: mdl-20632744
8.
A truncation hierarchy of coupled cluster models of strongly correlated systems based on perfect-pairing references: the singles+doubles models.
J Chem Phys
; 133(12): 124102, 2010 Sep 28.
Artigo
em Inglês
| MEDLINE | ID: mdl-20886919
9.
The perfect quadruples model for electron correlation in a valence active space.
J Chem Phys
; 130(8): 084101, 2009 Feb 28.
Artigo
em Inglês
| MEDLINE | ID: mdl-19256591
10.
The numerical condition of electron correlation theories when only active pairs of electrons are spin-unrestricted.
J Chem Phys
; 130(18): 184113, 2009 May 14.
Artigo
em Inglês
| MEDLINE | ID: mdl-19449914
11.
On the border between localization and delocalization: tris(iminoxolene)titanium(iv).
Dalton Trans
; 48(4): 1427-1435, 2019 Jan 22.
Artigo
em Inglês
| MEDLINE | ID: mdl-30628607
12.
Response to Commentary on "Force-field functor theory: classical force-fields which reproduce equilibrium quantum distributions".
Front Chem
; 1: 33, 2013.
Artigo
em Inglês
| MEDLINE | ID: mdl-24790961