Serguei Patchkovskii

发表

NMR chemical shifts in MNDO approximation: Parameters and results for H, C, N, and O

Walter Thiel, Serguei Patchkovskii, 1999, J. Comput. Chem..

Simple, accurate, and efficient implementation of 1-electron atomic time-dependent Schrödinger equation in spherical coordinates

Serguei Patchkovskii, H. G. Muller, H. Muller, 2016, Comput. Phys. Commun..

Performance of DFT in modeling electronic and structural properties of cobalamins

Serguei Patchkovskii, Jadwiga Kuta, Pawel M. Kozlowski, 2006, J. Comput. Chem..

Generic implementation of semi-analytical CI gradients for NDDO-type methods

Walter Thiel, Serguei Patchkovskii, Axel Koslowski, 2005 .

Orientation-dependent Stereo Wigner Time delay in a small molecule

Ursula Keller, Serguei Patchkovskii, Matteo Lucchini, 2017 .

Analytical second derivatives of the energy in MNDO methods

Walter Thiel, Serguei Patchkovskii, 1996, J. Comput. Chem..

Atomic scale modeling of polymerization catalysts

Tom K. Woo, Serguei Patchkovskii, Tom Ziegler, 2000, Computing in Science & Engineering.

Analytical first derivatives of the energy for small CI expansions

Walter Thiel, Serguei Patchkovskii, 1997 .

Interaction energies and NMR chemical shifts of noble gases in C60

Walter Thiel, Serguei Patchkovskii, Michael Bühl, 1997 .

Erratum: High Harmonic Generation and Molecular Orbital Tomography in Multielectron Systems: Beyond the Single Active Electron Approximation [Phys. Rev. Lett. 97 , 123003 (2006)]

Serguei Patchkovskii, David M. Villeneuve, Zengxiu Zhao, 2006 .

Analytical first derivatives of the energy in the MNDO half-electron open-shell treatment

Walter Thiel, Serguei Patchkovskii, S. Patchkovskii, 1996 .

High harmonic generation and molecular orbital tomography in multielectron systems: beyond the single active electron approximation.

Serguei Patchkovskii, Zengxiu Zhao, Thomas Brabec, 2006, Physical review letters.

Probing collective multi-electron dynamics in xenon with high-harmonic spectroscopy

Andrew D. Shiner, François Légaré, Jean-Claude Kieffer, 2011 .

NMR chemical shifts in MNDO approximation: Parameters and results for H, C, N, and O

Walter Thiel, Serguei Patchkovskii, 1999 .

An Efficient a Posteriori Treatment for Dispersion Interaction in Density-Functional-Based Tight Binding.

Serguei Patchkovskii, Gotthard Seifert, Lyuben Zhechkov, 2005, Journal of chemical theory and computation.

Dyson norms in XUV and strong-field ionization of polyatomics: Cytosine and uracil

Serguei Patchkovskii, Michael Spanner, Thomas Weinacht, 2012 .

Orientation-dependent stereo Wigner time delay and electron localization in a small molecule

Ursula Keller, Serguei Patchkovskii, Matteo Lucchini, 2019, EPJ Web of Conferences.

Radical Impurity Mechanisms for Helium Incorporation into Buckminsterfullerene

Walter Thiel, Serguei Patchkovskii, S. Patchkovskii, 1997 .

Signatures of the continuum electron phase in molecular strong-field photoelectron holography

Serguei Patchkovskii, Michael Spanner, Paul B. Corkum, 2014, Nature Physics.

On the origin of the ultrafast internal conversion of electronically excited pyrimidine bases.

Serguei Patchkovskii, E. C. Lim, S. Patchkovskii, 2005, The journal of physical chemistry. A.

Time-Resolved Dynamics in N2O4 Probed Using High Harmonic Generation

Albert Stolow, Serguei Patchkovskii, Henry C. Kapteyn, 2008, Science.

High harmonic interferometry of multi-electron dynamics in molecules

Nirit Dudovich, Serguei Patchkovskii, David Villeneuve, 2009, Nature.

How Does Helium Get into Buckminsterfullerene

Walter Thiel, Serguei Patchkovskii, S. Patchkovskii, 1996 .

Biradical radiationless decay channel in adenine and its derivatives

Serguei Patchkovskii, Marek Z. Zgierski, E. C. Lim, 2007 .

Equilibrium yield for helium incorporation into buckminsterfullerene: Quantum-chemical evaluation

Walter Thiel, Serguei Patchkovskii, S. Patchkovskii, 1997 .