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- 2003
-
Mark
The Electronic Spectrum of Re2Cl82-: A Theoretical Study
- Contribution to journal › Article
-
Mark
The ground state potential for the chromium dimer revisited.
- Contribution to journal › Article
-
Mark
Quantum refinement - a combination of quantum chemistry and protein crystallography.
Ryde, Ulf LU
and Nilsson, Kristina
LU
(2003)
In Journal of molecular structure. Theochem
632(1-3).
p.259-275
- Contribution to journal › Scientific review
-
Mark
Ab initio MP2 and DFT study of the thermal Syn elimination reaction in ethyl formate
(2003) In The Journal of Physical Chemistry Part A: Molecules, Spectroscopy, Kinetics, Environment and General Theory 107(10). p.1651-1654
- Contribution to journal › Article
-
Mark
Conversion of homocysteine to methionine by methionine synthase: a density functional study.
Jensen, Kasper LU and Ryde, Ulf LU
(2003)
In Journal of the American Chemical Society
125(46).
p.13970-13971
- Contribution to journal › Article
-
Mark
Semidirect parallel self-consistent field: the load balancing problem in the input/output intensive self-consistent field iterations
- Contribution to journal › Article
-
Mark
Nonlinear electric response of polyampholytes
- Contribution to journal › Article
-
Mark
On the effective interaction between an ion and a hydrophobic particle in polar solvents. A step towards an understanding of the hofmeister effect?
- Contribution to journal › Article
-
Mark
Phenyl versus ethyl transfer in the addition of organozinc reagents to aldehydes: A theoretical study
- Contribution to journal › Article
-
Mark
Inter- and intramolecular potential for the N-formylglycinamide-water system. A comparison between theoretical modeling and empirical force fields
- Contribution to journal › Article