Ab initio methods for the calculation of NMR shielding and indirect spin-spin coupling constants T Helgaker, M Jaszunski, K Ruud
Chemical Reviews 99, 293-352, 1999
1678 1999 The quantum-chemical calculation of NMR indirect spin–spin coupling constants T Helgaker, M Jaszuński, M Pecul
Progress in Nuclear Magnetic Resonance Spectroscopy 53 (4), 249-268, 2008
304 2008 Basis-set dependence of nuclear spin-spin coupling constants T Helgaker, M Jaszuński, K Ruud, A Górska
Theoretical Chemistry Accounts 99, 175-182, 1998
219 1998 Electric field dependence of magnetic properties: Multiconfigurational self‐consistent field calculations of hypermagnetizabilities and nuclear shielding polarizabilities of N2 … A Rizzo, T Helgaker, K Ruud, A Barszczewicz, M Jaszuński
The Journal of chemical physics 102 (22), 8953-8966, 1995
101 1995 Intraatomic correlation effects for the He–He dispersion and exchange–dispersion energies using explicitly correlated Gaussian geminals S Rybak, K Szalewicz, B Jeziorski, M Jaszunski
The Journal of chemical physics 86 (10), 5652-5659, 1987
96 1987 An ab initio study of the non-linear optical properties of the He atom and the H2 molecule M Jaszuński, BO Roos
Molecular Physics 52 (5), 1209-1224, 1984
87 1984 Alternative approach to the standardization of NMR spectra. Direct measurement of nuclear magnetic shielding in molecules K Jackowski, M Jaszuński, M Wilczek
The Journal of Physical Chemistry A 114 (7), 2471-2475, 2010
80 2010 The NMR indirect nuclear spin–spin coupling constants for some small rigid hydrocarbons: molecular equilibrium values and vibrational corrections TA Ruden, T Helgaker, M Jaszuński
Chemical physics 296 (1), 53-62, 2004
79 2004 Nuclear magnetic dipole moments from NMR spectra A Antušek, K Jackowski, M Jaszuński, W Makulski, M Wilczek
Chemical physics letters 411 (1-3), 111-116, 2005
73 2005 A CASSCF study of the potential curves for the X 1 Σ+ , B 1 Σ+ , and A 1 Π states of the BH molecule M Jaszuński, BO Roos, PO Widmark
The Journal of Chemical Physics 75 (1), 306-314, 1981
71 1981 On the performance of bond functions and basis set extrapolation techniques in high-accuracy calculations of interatomic potentials. A helium dimer study M Jeziorska, R Bukowski, W Cencek, M Jaszuński, B Jeziorski, ...
Collection of Czechoslovak chemical communications 68 (3), 463-488, 2003
64 2003 Spin–spin coupling constants and triplet instabilities in Kohn–Sham theory OB Lutnæs, T Helgaker, M Jaszuński
Molecular Physics 108 (19-20), 2579-2590, 2010
62 2010 The determination of accurate nuclear magnetic dipole moments and direct measurement of NMR shielding constants M Jaszuński, A Antušek, P Garbacz, K Jackowski, W Makulski, M Wilczek
Progress in Nuclear Magnetic Resonance Spectroscopy 67, 49-63, 2012
60 2012 Time-dependent Hartree-Fock calculations of dispersion energy M Jaszunski, R McWeeny
Molecular Physics 55 (6), 1275-1286, 1985
58 1985 An analysis and implementation of a general coupled cluster approach to excitation energies with application to the K Hald, P Jørgensen, J Olsen, M Jaszuński
The Journal of Chemical Physics 115 (2), 671-679, 2001
57 2001 Density-Functional and Coupled-Cluster Singles-and-Doubles Calculations of the Nuclear Shielding and Indirect Nuclear Spin− Spin Coupling Constants of o-Benzyne T Helgaker, OB Lutnæs, M Jaszuński
Journal of Chemical Theory and Computation 3 (1), 86-94, 2007
56 2007 Helium dimer interaction energies from Gaussian geminal and orbital calculations W Cencek, M Jeziorska, R Bukowski, M Jaszuński, B Jeziorski, ...
The Journal of Physical Chemistry A 108 (15), 3211-3224, 2004
56 2004 NMR Shielding Constants in PH3 , Absolute Shielding Scale, and the Nuclear Magnetic Moment of 31 P P Lantto, K Jackowski, W Makulski, M Olejniczak, M Jaszuński
The Journal of Physical Chemistry A 115 (38), 10617-10623, 2011
52 2011 The calculation of indirect nuclear spin–spin coupling constants in large molecules MA Watson, P Sałek, P Macak, M Jaszuński, T Helgaker
Chemistry–A European Journal 10 (18), 4627-4639, 2004
51 2004 Ab initio study of magnetochiral birefringenceS Coriani, M Pecul, A Rizzo, P Jørgensen, M Jaszuński
The Journal of chemical physics 117 (14), 6417-6428, 2002
50 2002 
Trygve HelgakerUniversity of OsloDirección de correo verificada de kjemi.uio.no
