The D alton quantum chemistry program system K Aidas, C Angeli, KL Bak, V Bakken, R Bast, L Boman, O Christiansen, ...
Wiley Interdisciplinary Reviews: Computational Molecular Science 4 (3), 269-284, 2014
1247 * 2014 DALTON, a molecular electronic structure program T Helgaker, HJA Jensen, P Jørgensen, J Olsen, K Ruud, H Ågren, ...
Release 1, 63, 2001
307 2001 The benzene–argon complex: A ground and excited state ab initio study H Koch, B Fernández, O Christiansen
The Journal of chemical physics 108 (7), 2784-2790, 1998
155 1998 The effect of intermolecular interactions on the electric properties of helium and argon. I. Ab initio calculation of the interaction induced polarizability and hyperpolarizability … C Hättig, H Larsen, J Olsen, P Jo/rgensen, H Koch, B Fernández, A Rizzo
The Journal of Chemical Physics 111 (22), 10099-10107, 1999
91 1999 Ground state benzene–argon intermolecular potential energy surface H Koch, B Fernández, J Makarewicz
The Journal of chemical physics 111 (1), 198-204, 1999
91 1999 The helium–, neon–, and argon–cyclopropane van der Waals complexes: Ab initio ground state intermolecular potential energy surfaces and intermolecular … TB Pedersen, B Fernández, H Koch, J Makarewicz
The Journal of Chemical Physics 115 (18), 8431-8439, 2001
87 2001 Gauge invariant coupled cluster response theory using optimized nonorthogonal orbitals TB Pedersen, B Fernández, H Koch
The Journal of Chemical Physics 114 (16), 6983-6993, 2001
84 2001 Coupled cluster calculations of the ground state potential and interaction induced electric properties of the mixed dimers of helium, neon and argon J López Cacheiro, B Fernández, D Marchesan, S Coriani, C Hättig, ...
Molecular Physics 102 (1), 101-110, 2004
83 2004 Dalton, an ab initio electronic structure program, Release 1.0 (1997) T Helgaker, HJA Jensen, P Jørgensen, J Olsen, K Ruud, H Ågren, ...
See http://www. kjemi. uio. no/software/dalton/dalton. html, 1997
80 1997 DALTON, a molecular electronic structure program H Agren, DJ Wilson, O Vahtras, PR Taylor, KO Sylvester-Hvid, ...
see http://www. kjemi. uio. no/software/dalton/dalton. html: University of Oslo,, 2005
69 2005 The effect of intermolecular interactions on the electric properties of helium and argon. III. Quantum statistical calculations of the dielectric second virial coefficients A Rizzo, C Hättig, B Fernández, H Koch
The Journal of chemical physics 117 (6), 2609-2618, 2002
67 2002 Wiley Interdiscip. Rev.: Comput. Mol. Sci. 4, 269 (2014) K Aidas, C Angeli, KL Bak, V Bakken, R Bast, L Boman, O Christiansen, ...
63 Dalton T Helgaker, HJA Jensen, P Jørgensen, J Olsen, K Ruud, H Aagren, ...
An ab initio electronic structure program, release 1, 1997
61 1997 The effect of intermolecular interactions on the electric properties of helium and argon. II. The dielectric, refractivity, Kerr, and hyperpolarizability second virial coefficients H Koch, C Hättig, H Larsen, J Olsen, P Jo/rgensen, B Fernández, A Rizzo
The Journal of Chemical Physics 111 (22), 10108-10118, 1999
60 1999 Rovibrational structure of the Ar–CO complex based on a novel three-dimensional ab initio potential T Bondo Pedersen, J López Cacheiro, B Fernández, H Koch
The Journal of chemical physics 117 (14), 6562-6572, 2002
57 2002 Spin polarization in restricted electronic structure theory: Multiconfiguration self‐consistent‐field calculations of hyperfine coupling constants B Fernandez, P Jo/rgensen, J Byberg, J Olsen, T Helgaker, HJA Jensen
The Journal of chemical physics 97 (5), 3412-3419, 1992
53 1992 DALTON, an ab initio electronic structure program, Release 1.2 T Helgaker, HJA Jensen, P Jørgensen, J Olsen, K Ruud, H Ågren, ...
See http://www. kjemi. uio. no/software/dalton/dalton. html, 2001
52 2001 Ab initio calculation of the frequency-dependent interaction induced hyperpolarizability of B Fernández, C Hättig, H Koch, A Rizzo
The Journal of chemical physics 110 (6), 2872-2882, 1999
51 1999 Ab initio ground-and excited-state intermolecular potential energy surfaces for the NO–Ne and NO–Ar van der Waals complexes H Cybulski, B Fernandez
The Journal of Physical Chemistry A 116 (27), 7319-7328, 2012
47 2012 Benzene-argon intermolecular potential energy surface B Fernández, H Koch, J Makarewicz
The Journal of chemical physics 111 (13), 5922-5928, 1999
45 1999