1 |
Intersystem Crossing and Characterization of Dark States in the Pyrimidine Nucleobases Uracil, Thymine, and 1-Methylthymine Etinski M, Fleig T, Marian CA Journal of Physical Chemistry A, 113(43), 11809, 2009 |
2 |
Four-Component Relativistic Coupled Cluster and Configuration Interaction Calculations on the Ground and Excited States of the RbYb Molecule Sorensen LK, Knecht S, Fleig T, Marian CM Journal of Physical Chemistry A, 113(45), 12607, 2009 |
3 |
Instability of the Al-4(2-) "All-Metal aromatic" ion and its implications Lambrecht DS, Fleig T, Sommerfeld T Journal of Physical Chemistry A, 112(13), 2855, 2008 |
4 |
Reply to "Comment on'Instability of the Al-4(2-)'All-Metal Aromatic' Ion and Its Implications"' Lambrecht DS, Fleig T, Sommerfeld T Journal of Physical Chemistry A, 112(34), 7986, 2008 |
5 |
Quantum-chemical investigation of the structures and electronic spectra of the nucleic acid bases at the coupled cluster CC2 level Fleig T, Knecht S, Hattig C Journal of Physical Chemistry A, 111(25), 5482, 2007 |
6 |
The generalized active space concept for the relativistic treatment of electron correlation. II. Large-scale configuration interaction implementation based on relativistic 2- and 4-spinors and its application Fleig T, Olsen J, Visscher L Journal of Chemical Physics, 119(6), 2963, 2003 |
7 |
The generalized active space concept for the relativistic treatment of electron correlation. I. Kramers-restricted two-component configuration interaction Fleig T, Olsen J, Marian CM Journal of Chemical Physics, 114(11), 4775, 2001 |
8 |
Relativistic ab-initio calculations on PdH and PdD: The rovibronic spectra and rotational splittings Fleig T, Marian CM Journal of Chemical Physics, 108(9), 3517, 1998 |