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Mostrati risultati da 81 a 100 di 146
Titolo Data di pubblicazione Autori Tipo File
Argon broadening of the13CO R(0) and R(7) transitions in the fundamental band at temperatures between 80 and 297 K: Comparison between experiment and theory 2003 Koch, H. + 1.1 Articolo in rivista
Coupled cluster calculations of the vertical excitation energies of tetracyanoethylene 2003 Koch, Henrik + 1.1 Articolo in rivista
Study of the benzene·N2intermolecular potential-energy surface 2003 Koch, Henrik + 1.1 Articolo in rivista
Polarizabilities of small annulenes from Cholesky CC2 linear response theory 2004 Koch, H. + 1.1 Articolo in rivista
Origin invariant calculation of optical rotation without recourse to London orbitals 2004 Koch, Henrik + 1.1 Articolo in rivista
Polarizability and optical rotation calculated from the approximate coupled cluster singles and doubles CC2 linear response theory using cholesky decompositions 2004 Koch, Henrik + 1.1 Articolo in rivista
Ab initio calculation of optical rotation in (P)-(+)-[4]triangulane 2005 Koch, Henrik + 1.1 Articolo in rivista
Carbon nanorings: A challenge to theoretical chemistry 2006 Koch, H. + 1.1 Articolo in rivista
Fast noniterative orbital localization for large molecules 2006 Koch, Henrik + 1.1 Articolo in rivista
Ab initio potential-energy surface and rovibrational states of the HCN-HCl complex 2006 Koch, Henrik + 1.1 Articolo in rivista
Basis set limits of the second order Møller-Plesset correlation energies of water, methane, acetylene, ethylene, and benzene 2007 Koch, Henrik + 1.1 Articolo in rivista
Coupled cluster calculations of interaction energies in benzene-fluorobenzene van der Waals complexes 2007 Koch, Henrik + 1.1 Articolo in rivista
Method specific Cholesky decomposition: Coulomb and exchange energies 2008 Koch, Henrik + 1.1 Articolo in rivista
Accurate ab initio density fitting for multiconfigurational self-consistent field methods 2008 Koch, Henrik + 1.1 Articolo in rivista
Variation of polarizability in the [4n + 2] annulene series: from [22]- to [66]-annulene 2008 Koch, Henrik + 1.1 Articolo in rivista
Coupled cluster response theory in parameter subspaces 2009 Koch, Henrik + 1.1 Articolo in rivista
Cholesky decomposition-based definition of atomic subsystems in electronic structure calculations 2010 Koch, Henrik + 1.1 Articolo in rivista
The CCSD(T) model with Cholesky decomposition of orbital energy denominators 2011 Koch, Henrik + 1.1 Articolo in rivista
Cholesky Decomposition Techniques in Electronic Structure Theory 2011 Henrik Koch + 2.1 Contributo in volume (Capitolo o Saggio)
The extended CC2 model ECC2 2013 Koch, Henrik + 1.1 Articolo in rivista
Mostrati risultati da 81 a 100 di 146
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