JK
Kaminski, Jakub Wojciech
| Title | Published in | Access level | OA Policy | Year | Views | Downloads | |
|---|---|---|---|---|---|---|---|
| Multi-scale modelling of solvatochromic shifts from frozen-density embedding theory with non-uniform continuum model of the solvent: the coumarin 153 case | PCCP. Physical chemistry chemical physics | 2011 | 618 | 0 | |||
| Development and applications of non-empirical methods for modeling electronic structure in condensed phase | 2010 | 1,085 | 981 | ||||
| Thermal Desorption, Vibrational Spectroscopic, and DFT Computational Studies of the Complex Manganese Borohydrides Mn(BH4)2 and [Mn(BH4)4]2− | Journal of physical chemistry. C | 2010 | 835 | 1 | |||
| Modeling Solvatochromic Shifts Using the Orbital-Free Embedding Potential at Statistically Mechanically Averaged Solvent Density | The journal of physical chemistry. A | 2010 | 656 | 0 | |||
| Cooperative effect of hydrogen-bonded chains in the environment of a π → π* chromophore | The journal of physical chemistry. A | 2009 | 678 | 444 | |||
| Linearized orbital-free embedding potential in self-consistent calculations | International journal of quantum chemistry | 2009 | 757 | 413 | |||
| The energy-differences based exact criterion for testing approximations to the functional for the kinetic energy of non-interacting electrons | Journal of physics. A, mathematical and general | 2008 | 707 | 425 | |||
| Orbital-free effective embedding potential at nuclear cusps | The Journal of chemical physics | 2008 | 644 | 0 | |||
| LiSc(BH4)4: A Novel Salt of Li+ and Discrete Sc(BH4)4− Complex Anions | The journal of physical chemistry. A | 2008 | 783 | 542 | |||
| Equilibrium Geometries of Noncovalently Bound Intermolecular Complexes Derived from Subsystem Formulation of Density Functional Theory | Journal of chemical theory and computation | 2007 | 741 | 629 |
