691 – 700 of 924
- show: 10
- |
- sort: year (new to old)
Close
Embed this list
<iframe src=" "
width=" "
height=" "
allowtransparency="true"
frameborder="0">
</iframe>
- 2006
-
Mark
How accurate is the CASPT2 method?
(
- Contribution to journal › Article
-
Mark
Surface charge density and electrokinetic potential of highly charged minerals: Experiments and Monte Carlo simulations on calcium silicate hydrate
(
- Contribution to journal › Article
-
Mark
Nitrogen-doped carbon nanotubes under electron irradiation simulated with a tight-binding model
(
- Contribution to journal › Article
-
Mark
EXAFS structure refinement supplemented by computational chemistry
(
- Contribution to journal › Article
-
Mark
Exploring the actinide-actinide bond: Theoretical studies of the chemical bond in Ac-2, Th-2, Pa-2, and U-2
(
- Contribution to journal › Article
-
Mark
The reaction mechanism of iron and manganese superoxide dismutases studied by theoretical calculations
(
- Contribution to journal › Article
-
Mark
Development and Implementation of Methods in Theoretical Chemistry
2006)(
- Thesis › Doctoral thesis (monograph)
-
Mark
Electrostatic Interactions In and Between Biomolecules
2006)(
- Thesis › Doctoral thesis (compilation)
-
Mark
Cholesky Decomposition of the two-electron integrals: A reliable tool for linear scaling methods?
2006) International Conference on Computational Methods in Science and Engineering 7A-B. p.1299-1299(
- Chapter in Book/Report/Conference proceeding › Paper in conference proceeding
-
Mark
Spectral and density functional studies on the absorbance and fluorescence spectra of 2-R-5-phenyl-1,3,4-oxadiazoles and their conjugate acids
2006) In The Journal of Physical Chemistry Part A: Molecules, Spectroscopy, Kinetics, Environment and General Theory 110(28). p.8750-8757(
- Contribution to journal › Article