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The mechanism of the ozonolysis on the surface of C70 fullerene: the electron localizability indicator study

Journal of molecular modeling, 2020-04, Vol.26 (4), p.73-73, Article 73

2020

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Investigations of the Very Short Hydrogen Bond in the Crystal of Nitromalonamide via Car–Parrinello and Path Integral Molecular Dynamics

The journal of physical chemistry. B, 2013-05, Vol.117 (18), p.5430-5440

2013

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Photoinduced double proton transfer in the glyoxal-methanol complex along T-1 reaction path - a quantum chemical topological study

Journal of molecular structure, 2021, Vol.1227

2021

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The mechanism of the ozonolysis on the surface of C 70 fullerene: the electron localizability indicator study

Journal of molecular modeling, 2020-03, Vol.26 (4), p.73

2020

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Trimers and tetramers of MH and MH3 (M=Al, Ga): Theoretical study

Chemical physics, 2006-09, Vol.327 (2-3), p.247-260

2006

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Photoinduced double proton transfer in the glyoxal-methanol complex along T1 reaction path – a quantum chemical topological study

Journal of molecular structure, 2021-03, Vol.1227, p.129426, Article 129426

2021

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The potential of the research by design method in balancing water problems: An integrated water and space management program for a part of the Warsaw agglomeration

Cities, 2022-02, Vol.121, p.103455, Article 103455

2022

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Homoleptic aminophenolates of Zn, Mg and Ca. Synthesis, structure, DFT studies and polymerization activity in ROP of lactides

Dalton transactions : an international journal of inorganic chemistry, 2014-01, Vol.43 (6), p.2424-2436

2014

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Experimental and Theoretical Study of the Photophysics and Structures of Europium Cryptates Incorporating 3,3′-Bi-isoquinoline-2,2′-dioxide

Chemphyschem, 2004-10, Vol.5 (10), p.1577-1584

2004

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Matrix-Isolated Hydrogen-Bonded and Van der Waals Complexes of Hydrogen Peroxide with OCS and CS2

Chemphyschem, 2013-03, Vol.14 (4), p.777-787

2013

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OH-Induced Oxidative Cleavage of Dimethyl Disulfide in the Presence of NO

The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory, 2013-08, Vol.117 (34), p.8263-8273

2013

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Homo- and heteroleptic zinc aminophenolates as initiators for lactide polymerization

Dalton transactions : an international journal of inorganic chemistry, 2008-01 (46), p.6556-6562

2008

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Matrix‐Isolated Hydrogen‐Bonded and Van der Waals Complexes of Hydrogen Peroxide with OCS and CS 2

Chemphyschem, 2013-03, Vol.14 (4), p.777-787

2013

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AIM and ELF analysis of the H-, Me-, and F-substituted Fe III–TAML complexes

Chemical physics letters, 2011, Vol.507 (1), p.29-36

2011

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Effects of Xenon Insertion into Hydrogen Bromide. Comparison of the Electronic Structure of the HBr···CO 2 and HXeBr···CO 2 Complexes Using Quantum Chemical Topology Methods: Electron Localization Function, Atoms in Molecules and Symmetry Adapted Perturbation Theory

The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory, 2014-06, Vol.118 (22), p.3980-3989

2014

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Effects of Xenon Insertion into Hydrogen Bromide. Comparison of the Electronic Structure of the HBr···CO2 and HXeBr···CO2 Complexes Using Quantum Chemical Topology Methods: Electron Localization Function, Atoms in Molecules and Symmetry Adapted Perturbation Theory

The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory, 2014-06, Vol.118 (22), p.3980-3989

2014

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Effects of Xenon Insertion into Hydrogen Bromide. Comparison of the Electronic Structure of the HBr...CO sub(2) and HXeBr...CO sub(2) Complexes Using Quantum Chemical Topology Methods: Electron Localization Function, Atoms in Molecules and Symmetry Adapted Perturbation Theory

The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory, 2014-06, Vol.118 (22), p.3980-3989-3980-3989

2014

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AIM and ELF analysis of the H-, Me-, and F-substituted FeIII–TAML complexes

Chemical physics letters, 2011-04, Vol.507 (1-3), p.29-36

2011

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Basis set superposition error in N-body clusters

Chemical physics letters, 2003-10, Vol.380 (5), p.654-664

2003

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Homoleptic aminophenolates of Zn, Mg and Ca. Synthesis, structure, DFT studies and polymerization activity in ROP of lactidesElectronic supplementary information (ESI) available: Additional tables and figures of DFT calculations. CCDC 962645 and 969646. For ESI and crystallographic data in CIF or other electronic format see DOI: 10.1039/c3dt52868e

2014-01

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The protocovalent N O bond: Quantum chemical topology (QCT of ELF and ELI-D) study on the bonding in the nitrous acid H O N O and its relevancy to the experiment

Chemical physics letters, 2008-07, Vol.460 (4), p.559-562

2008

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Computational and experimental studies into NMR characterization of [2+2] cycloaddition products of norbornene

Chemical physics letters, 2011-06, Vol.510 (1-3), p.115-119

2011

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Structural role of hydrogen bond networks in amino acid–acid systems. (I) The network with highly polarizable OHO hydrogen bonds in sarcosine–methanesulfonic acid (2:1) crystal

Chemical physics, 2008-07, Vol.351 (1), p.99-105

2008

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Nature of bonding in substituted polyacetylene: A combined AIM–ELF analysis

Journal of molecular structure, 2010-07, Vol.976 (1), p.392-396

2010

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Trapping the Dirhenium Alkynyl Fischer Type Carbene through Michael Addition. Unexpected Room-Temperature E/Z Isomerization of (CO)5Re(CO)4Re(C(OMe)CHC(NMe2)TMS)

Organometallics, 2006-07, Vol.25 (15), p.3544-3547

2006

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The mechanism of the ozonolysis on the surface of C70 fullerene: the electron localizability indicator study

Investigations of the Very Short Hydrogen Bond in the Crystal of Nitromalonamide via Car–Parrinello and Path Integral Molecular Dynamics

Photoinduced double proton transfer in the glyoxal-methanol complex along T-1 reaction path - a quantum chemical topological study

The mechanism of the ozonolysis on the surface of C 70 fullerene: the electron localizability indicator study

Trimers and tetramers of MH and MH3 (M=Al, Ga): Theoretical study

Photoinduced double proton transfer in the glyoxal-methanol complex along T1 reaction path – a quantum chemical topological study

The potential of the research by design method in balancing water problems: An integrated water and space management program for a part of the Warsaw agglomeration

Homoleptic aminophenolates of Zn, Mg and Ca. Synthesis, structure, DFT studies and polymerization activity in ROP of lactides

Experimental and Theoretical Study of the Photophysics and Structures of Europium Cryptates Incorporating 3,3′-Bi-isoquinoline-2,2′-dioxide

Matrix-Isolated Hydrogen-Bonded and Van der Waals Complexes of Hydrogen Peroxide with OCS and CS2

OH-Induced Oxidative Cleavage of Dimethyl Disulfide in the Presence of NO

Homo- and heteroleptic zinc aminophenolates as initiators for lactide polymerization

Matrix‐Isolated Hydrogen‐Bonded and Van der Waals Complexes of Hydrogen Peroxide with OCS and CS 2

AIM and ELF analysis of the H-, Me-, and F-substituted Fe III–TAML complexes

Effects of Xenon Insertion into Hydrogen Bromide. Comparison of the Electronic Structure of the HBr···CO 2 and HXeBr···CO 2 Complexes Using Quantum Chemical Topology Methods: Electron Localization Function, Atoms in Molecules and Symmetry Adapted Perturbation Theory

Effects of Xenon Insertion into Hydrogen Bromide. Comparison of the Electronic Structure of the HBr···CO2 and HXeBr···CO2 Complexes Using Quantum Chemical Topology Methods: Electron Localization Function, Atoms in Molecules and Symmetry Adapted Perturbation Theory

Effects of Xenon Insertion into Hydrogen Bromide. Comparison of the Electronic Structure of the HBr...CO sub(2) and HXeBr...CO sub(2) Complexes Using Quantum Chemical Topology Methods: Electron Localization Function, Atoms in Molecules and Symmetry Adapted Perturbation Theory

AIM and ELF analysis of the H-, Me-, and F-substituted FeIII–TAML complexes

Basis set superposition error in N-body clusters

The protocovalent N O bond: Quantum chemical topology (QCT of ELF and ELI-D) study on the bonding in the nitrous acid H O N O and its relevancy to the experiment

Computational and experimental studies into NMR characterization of [2+2] cycloaddition products of norbornene

Structural role of hydrogen bond networks in amino acid–acid systems. (I) The network with highly polarizable OHO hydrogen bonds in sarcosine–methanesulfonic acid (2:1) crystal

Nature of bonding in substituted polyacetylene: A combined AIM–ELF analysis

Trapping the Dirhenium Alkynyl Fischer Type Carbene through Michael Addition. Unexpected Room-Temperature E/Z Isomerization of (CO)5Re(CO)4Re(C(OMe)CHC(NMe2)TMS)

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