Publications | Lund University Publications

1061 – 1070 of 1132

show: 10
|
sort: year (new to old)

News feed Embed this list Save this search Mark all Export

Cancel

Embed this list

copy and paste the html snippet below into your own page:

<iframe src="https://lup.lub.lu.se/search/publication?embed=1&q=department+exact+V1000659&amp;hide_pagination=1&amp;hide_info=1&amp;hide_options=1"
  width="100%"
  height="400"
  allowtransparency="true"
  frameborder="0">
</iframe>

« previous
1
…
106
107
108
109
…
114
next »

2002
Mark Toward an understanding of the Hofmeister effect: A computer game with dipoles and an ion
Karlström, Gunnar ^LU and Hagberg, Daniel ^LU (2002) In The Journal of Physical Chemistry Part B 106(44). p.11585-11592
- Contribution to journal › Article
Mark Simple approach to polyampholytes based on chain polarizabilities
Khan, Malek O ; Åkesson, Torbjörn ^LU and Jönsson, Bo ^LU (2002) In Journal of Chemical Physics 116(9). p.3917-3924
- Contribution to journal › Article
Mark Implementation of electronic ground states and singlet and triplet excitation energies in coupled cluster theory with approximate triples corrections
Hald, K ; Jorgensen, P ; Christiansen, Ove ^LU and Koch, H (2002) In Journal of Chemical Physics 116(14). p.5963-5970
- Contribution to journal › Article
Mark Radiative singlet-triplet transition properties from coupled-cluster response theory: The importance of the S-0 -> T-1 transition for the photodissociation of water at 193 nm
Christiansen, Ove ^LU and Gauss, J (2002) In Journal of Chemical Physics 116(15). p.6674-6686
- Contribution to journal › Article
Mark A linear response approach to second-order electronic transition intensities for multiconfigurational self-consistent field wave functions
Stålring, Jonna ; Bernhardsson, Anders and Malmqvist, Per-Åke ^LU (2002) In Journal of Chemical Physics 117(3). p.1010-1016
- Contribution to journal › Article
2001
Mark Inner-sphere reorganization energy of iron-sulfur clusters studied with theoretical methods
Sigfridsson, Emma ; Olsson, Mats H. M. and Ryde, Ulf ^LU (2001) In Inorganic Chemistry 40(11). p.2509-2519
- Contribution to journal › Article
Mark A comparison of the inner-sphere reorganization energies of cytochromes, iron-sulphur clusters, and blue copper proteins
Sigfridsson, Emma ; Olsson, Mats H. M. and Ryde, Ulf ^LU (2001) In The Journal of Physical Chemistry Part B 105(23). p.5546-5552
- Contribution to journal › Article
Mark Lattice model calculations of interactions between proteins and surface grafted polymers with tethered affinity ligands
Karlström, Gunnar ^LU and Johansson, Hans-Olof ^LU (2001) In Colloids and Surfaces B: Biointerfaces 20(3). p.245-256
- Contribution to journal › Article
Mark Geometry, Reduction Potential, and Reorganization Energy of the Binuclear CuA Site, Studied by Density Functional Theory
Olsson, Mats H. M. and Ryde, Ulf ^LU (2001) In Journal of the American Chemical Society 123(32). p.7866-7876
- Contribution to journal › Article
Mark A theoretical study of the copper–cysteine bond in blue copper proteins
Ryde, Ulf ^LU ; Olsson, Mats H. M. ; Roos, Björn ^LU and Borin-Carlos, Antonio (2001) In Theoretical Chemistry Accounts 105(6). p.452-462
- Contribution to journal › Article

« previous
1
…
106
107
108
109
…
114
next »

your query:: Remove department: Computational Chemistry