E-LIB Suche - Ergebnisse für: Chałasiński, Grzegorz

1

Reassessing the Role of σ Holes in Noncovalent Interactions..:

Szczęśniak, Małgorzata M ; Chałasinski, Grzegorz
http://www.ncbi.nlm.nih.gov/pmc/articles/PMC9021534/. , 2022

2

Assessment of SAPT(DFT) with meta-GGA functionals:

Hapka, Michał ; Modrzejewski, Marcin ; Chałasiński, Grzegorz.
http://www.ncbi.nlm.nih.gov/pmc/articles/PMC7256086/. , 2020

Link: http://www.ncbi.nlm.nih...

3

The nature of three-body interactions in DFT: exchange and ..:

Hapka, Michał ; Rajchel, Łukasz ; Modrzejewski, Marcin...
http://arxiv.org/abs/1706.07982. , 2017

Link: http://arxiv.org/abs/170..

4

Employing Range Separation on the meta-GGA Rung: New Functi..:

Modrzejewski, Marcin ; Hapka, Michał ; Chałasiński, Grzegorz.
J. Chem. Theory Comput. 12, 3662 (2016); doi:10.1021/acs.jctc.6b00406. , 2016

Link: https://depot.ceon.pl/ha..

5

Employing Range Separation on the meta-GGA Rung: New Functi..:

Modrzejewski, Marcin ; Hapka, Michal ; Chalasinski, Grzegorz.
http://arxiv.org/abs/1608.00035. , 2016

Link: http://arxiv.org/abs/160..

6

Range-separated meta-GGA functional designed for noncovalen..:

Modrzejewski, Marcin ; Chałasiński, Grzegorz ; Szczęśniak, Małgorzata M
http://arxiv.org/abs/1409.7431. , 2014

Link: http://arxiv.org/abs/140..

7

A first-principles-based correlation functional for harmoni..:

Modrzejewski, Marcin ; Lesiuk, Michał ; Rajchel, Łukasz..
http://arxiv.org/abs/1405.1466. , 2014

Link: http://arxiv.org/abs/140..

8

Tuned range-separated hybrid functionals in the symmetry-ad..:

Hapka, Michał ; Modrzejewski, Marcin ; Chałasiński, Grzegorz..
doi:10.1063/1.4896608. , 2014

Link: https://depot.ceon.pl/ha..

9

Density-dependent onset of the long-range exchange: a key t..:

Modrzejewski, Marcin ; Rajchel, Łukasz ; Chałasiński, Grzegorz.
doi:10.1021/jp4088404. , 2013

Link: https://depot.ceon.pl/ha..

10

Notes on ab initio investigation of the CrH molecule and it..:

Kłos, Jacek ; Hapka, Michał ; Chałasiński, Grzegorz
http://arxiv.org/abs/1312.4796. , 2013

Link: http://arxiv.org/abs/131..

11

First-principle interaction potentials for metastable He($^..:

Hapka, Michał ; Chalasinski, Grzegorz ; Kłos, Jacek.
http://arxiv.org/abs/1304.3686. , 2013

Link: http://arxiv.org/abs/130..

12

Density-Dependent Onset of the Long-Range Exchange: A Key t..:

Modrzejewski, Marcin ; Chałasiński, Grzegorz ; Szczęśniak, Małgorzata M
http://arxiv.org/abs/1305.6869. , 2013

Link: http://arxiv.org/abs/130..

13

Dispersion-free component of non-covalent interaction via m..:

Modrzejewski, Marcin ; Rajchel, Łukasz ; Szczęśniak, Małgorzata M.
doi:10.1063/1.4705282. , 2012

Link: http://depot.ceon.pl/han..

14

A first-principles-based correlation functional for harmoni..:

Modrzejewski, Marcin ; Lesiuk, Michał ; Rajchel, Łukasz..
Modrzejewski M, Lesiuk M, Rajchel Ł, Szczęśniak MM, Chałasiński G. A first-principles-based correlation functional for harmonious connection of short-range correlation and long-range dispersion. J Chem Phys. 2012 Nov 28;137(20):204121. doi:10.1063/1.4768228.. , 2012

Link: https://depot.ceon.pl/ha..

15

A DFT Approach to Non-Covalent Interactions via Monomer Pol..:

Rajchel, Łukasz ; Żuchowski, Piotr S ; Szczęśniak, Małgorzata M.
doi:10.1103/PhysRevLett.104.163001. , 2010

Link: http://depot.ceon.pl/han..