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- 2003
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Mark
On the influence of the basis set superposition error on calculated vibrational frequencies
(
- Contribution to journal › Article
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Mark
Phase behavior of an ionic surfactant with mixed monovalent/polymeric counterions
(
- Contribution to journal › Article
-
Mark
Theoretical prediction of the co-c bond strength in cobalamins.
2003) In The Journal of Physical Chemistry Part A: Molecules, Spectroscopy, Kinetics, Environment and General Theory 107(38). p.7539-7545(
- Contribution to journal › Article
-
Mark
An automatic method to generate force-field parameters for hetero-compounds.
(
- Contribution to journal › Article
-
Mark
Quantum Chemical Interpretation of Protein Crystal Structure
2003)(
- Thesis › Doctoral thesis (compilation)
-
Mark
Bjorn's top ten
(
- Contribution to journal › Letter
-
Mark
Heavy element quantum chemistry - the multiconfigurational approach.
2003)(
- Chapter in Book/Report/Conference proceeding › Book chapter
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Mark
Molecular orbital theory.
2003) In Comprehensive Coordination Chemistry 2 (Vol. 1)(
- Chapter in Book/Report/Conference proceeding › Book chapter
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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
Free Energy and Surface Forces in polymer systems: Monte Carlo Simulation Studies
2003)(
- Thesis › Doctoral thesis (compilation)