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- 2005
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Mark
Perspectives in Calculations on Excited State in Molecular Systems
2005)(
- Chapter in Book/Report/Conference proceeding › Book chapter
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Mark
The electronic spectrum of the UO2 molecule
(
- Contribution to journal › Article
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Mark
The coordination of uranyl in water: A combined quantum chemical and molecular simulation study
(
- Contribution to journal › Article
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Mark
New relativistic ANO basis sets for transition metal atoms
2005) In The Journal of Physical Chemistry Part A: Molecules, Spectroscopy, Kinetics, Environment and General Theory 109(29). p.6575-6579(
- Contribution to journal › Article
- 2004
-
Mark
Collisional properties of trapped cold chromium atoms
(
- Contribution to journal › Article
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Mark
2MOLCAS as a development platform for quantum chemistry software
(
- Contribution to journal › Article
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Mark
A theoretical study of the excited states of CrH: Potential energies, transition moments, and lifetimes
(
- Contribution to journal › Article
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Mark
Main group atoms and dimers studied with a new relativistic ANO basis set
2004) In The Journal of Physical Chemistry Part A: Molecules, Spectroscopy, Kinetics, Environment and General Theory 108(15). p.2851-2858(
- Contribution to journal › Article
-
Mark
A theoretical study of the bonding in trivalent americium complexes
(
- Contribution to journal › Article
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Mark
A modified definition of the zeroth-order Hamiltonian in multiconfigurational perturbation theory (CASPT2)
(
- Contribution to journal › Article