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- 2004
-
Mark
2MOLCAS as a development platform for quantum chemistry software
(
- Contribution to journal › Article
-
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
Relativistic atomic natural orbital type basis sets for the alkaline and alkaline-earth atoms applied to the ground-state potentials for the corresponding dimers
(
- Contribution to journal › Article
- 2003
-
Mark
The ground state and electronic spectrum of CUO - a mystery.
(
- Contribution to journal › Article
-
Mark
Molcas: a program package for computational chemistry.
2003) Symposium on Software Development for Process and Materials Disign In Computational Materials Science 28(2). p.222-239(
- Contribution to journal › Article
-
Mark
Molcas programmer’s guide
2003)(
- Book/Report › Report
- 2002
-
Mark
The ammonia dimer equilibrium dissociation energy: convergence to the basis set limit at the correlated level
(
- Contribution to journal › Article
-
Mark
Theoretical study of the unusual potential energy curve of the A (1)Sigma(+) state of AgH
(
- Contribution to journal › Article
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