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2006, Challenges and advances in computational chemistry and physics, ISBN 9781402048524, Volume 3., xx, 519
Links theoretical studies with experimental resultsCovers the most important recent aspects in H-bonding Includes numerous examples to allow a greater... 
Hydrogen bonding | Physical organic chemistry | Theoretical and Computational Chemistry | Chemistry | Physical Chemistry | Crystallography | Math. Applications in Chemistry | Computer Applications in Chemistry
Book
Molecules, ISSN 1420-3049, 2018, Volume 23, Issue 5, p. 1183
MP2/aug-cc-pVTZ calculations were carried out for the ZFH3-B complexes (Z = C, Si, Ge, Sn and Pb; B = C2H2, C2H4, C6H6 and C5H5-; relativistic effects were... 
Σ-hole | Tetrel bond | Π-electrons as Lewis bases | Electron charge shifts | Hydrogen bond | Deformation | Atomic properties | Molecular chains | Relativistic effects | Hydrogen bonds | Mathematical analysis | Lead | Tin | Germanium | Silicon | Lewis base | Atomic structure | Hydrogen ion concentration | Quantum theory | Electrons
Journal Article
Physical Chemistry Chemical Physics : PCCP, ISSN 1463-9076, 01/2017, Volume 19, Issue 44, pp. 29742 - 29759
The hydrogen bond interaction and σ-hole and π-hole bonds are steered by the same mechanisms. There is electron charge transfer from the Lewis base to the... 
Lewis acid | Polarization | Chemical reactions | Covalent bonds | Strong interactions (field theory) | Electronic structure | Hydrogen bonds | Bonding strength | Chemical bonds | Outflow | Charge transfer | Lewis base | Electrons
Journal Article
Coordination Chemistry Reviews, ISSN 0010-8545, 03/2020, Volume 407, p. 213171
[Display omitted] •The triel bond interaction is defined and characterised.•Mechanisms of formation of various interactions are discussed and compared with the... 
Coordination | Electron charge shift | Triel bond | Hydrogen bond | Crystal structure
Journal Article
Crystals, ISSN 2073-4352, 02/2017, Volume 7, Issue 2, p. 43
Tetrel bond is analysed for a series of ZF4 (Z = C, Si, Ge) complexes with one and two NH3 or AsH3 ligands. The MP2/aug-cc-pVTZ calculations were performed and... 
Natural bond orbital (NBO) method | Quantum theory of “atoms in molecules” | Tetrel bond | Electron charge density shift | σ-hole | Ligands | electron charge density shift | tetrel bond | Quantum Theory of “Atoms in Molecules” | Natural Bond Orbital (NBO) method
Journal Article
Physical Chemistry Chemical Physics, ISSN 1463-9076, 11/2017, Volume 19, Issue 44, pp. 29742 - 29759
The hydrogen bond interaction and σ-hole and π-hole bonds are steered by the same mechanisms. There is electron charge transfer from the Lewis base to the... 
Journal Article
ChemPhysChem, ISSN 1439-4235, 08/2018, Volume 19, Issue 15, pp. 1798 - 1798
The Cover Feature shows molecular graphs with the electrostatic potential (EP) surfaces (the electron density of 0.001 au) of selected beryllium and magnesium... 
electrostatic potential | beryllium | magnesium | electron charge shift | coordination
Journal Article
Physical chemistry chemical physics : PCCP, ISSN 1463-9076, 02/2014, Volume 16, Issue 5, pp. 1824 - 1834
MP2/aug-cc-pVTZ calculations were carried out on complexes of ZH4, ZFH3 and ZF4 (Z = C, Si and Ge) molecules with HCN, LiCN and Cl(-) species acting as Lewis... 
Models, Molecular | Quantum Theory | Nitrogen - chemistry | Chlorine - chemistry | Lewis Bases - chemistry
Journal Article
Physical Chemistry Chemical Physics, ISSN 1463-9076, 1/2014, Volume 16, Issue 5, pp. 1824 - 1834
MP2/aug-cc-pVTZ calculations were carried out on complexes of ZH 4 , ZFH 3 and ZF 4 (Z = C, Si and Ge) molecules with HCN, LiCN and Cl − species acting as... 
Journal Article
Molecules (Basel, Switzerland), 05/2018, Volume 23, Issue 5
MP2/aug-cc-pVTZ calculations were carried out for the ZFH₃-B complexes (Z = C, Si, Ge, Sn and Pb; B = C₂H₂, C₂H₄, C₆H₆ and C₅H₅⁻; relativistic effects were... 
Models, Theoretical | Models, Molecular | Hydrogen Bonding | Molecular Conformation | Lewis Bases - chemistry | Electrons
Journal Article
ChemPhysChem, ISSN 1439-4235, 02/2019, Volume 20, Issue 4, pp. 565 - 574
ωB97XD/aug‐cc‐pVTZ calculations were performed for complexes of dihydrogen, cyclopropane, cyclobutane and cyclopentane, with simple proton donating species... 
electrostatic potential | A−H…σ hydrogen bond | Quantum Theory of ‘Atoms in Molecules’ (QTAIM) | Natural Bond Orbital (NBO) method | energy decomposition analysis (EDA)
Journal Article
ChemPhysChem, ISSN 1439-4235, 04/2014, Volume 15, Issue 5, pp. 805 - 805
Journal Article
Chemical Physics Letters, ISSN 0009-2614, 01/2014, Volume 591, pp. 113 - 118
The lithium bond is characterized by the unique properties; for Z–Li bonds which interact with Lewis bases through Li-centre the effect of the σ-hole formation... 
Journal Article
The Journal of Physical Chemistry A, ISSN 1089-5639, 05/2011, Volume 115, Issue 18, pp. 4765 - 4773
The MP2/6-311++G(d,p) calculations were performed on several hydrogen-bonded systems. Different complexes were taken into account to analyze various types of... 
A: Molecular Structure, Quantum Chemistry, General Theory | Benzene - chemistry | Chloroform - chemistry | Quantum Theory | Hydrogen Bonding
Journal Article
Journal of Physical Organic Chemistry, ISSN 0894-3230, 06/2013, Volume 26, Issue 6, pp. 452 - 459
Dihydrogen bond (DHB) and X–H…σ interaction are discussed and compared here. Both interactions possess numerous characteristics of the hydrogen bond (HB). The... 
X–H…π interaction | dihydrogen bond | X–H…σ interaction | hydrogen bond | X-H.σ interaction | X-H.π interaction
Journal Article
ChemPhysChem, ISSN 1439-4235, 05/2015, Volume 16, Issue 7, pp. 1470 - 1479
MP2/aug‐cc‐pVTZ calculations were performed on complexes of boron and aluminum trihydrides and trihalides with hydrogen cyanide (ZH3‐NCH and ZX3‐NCH; Z=B, Al;... 
Lewis acids | pi‐hole bonds | aluminum | boron | Lewis bases | pi-hole bonds
Journal Article
Structural Chemistry, ISSN 1040-0400, 08/2017, Volume 28, Issue 4, pp. 1163 - 1171
Triel bond is an interaction of an atom of the 13th Group of periodic system that acts as a Lewis acid with an electron rich species; it is analyzed here in... 
Bond path | Electron charge density shifts | π-hole bond | Boron and aluminum Lewis acid centers | Triel bond | Quantum Theory of Atoms in Molecules | AMMONIA | pi-hole bond | AB-INITIO | CHEMISTRY, PHYSICAL | CRYSTALLOGRAPHY | CH3CN-BF3 | CHEMISTRY, MULTIDISCIPLINARY | BF3 | HYDROGEN | ENERGETIC PROPERTIES | BCL3 | LEWIS-ACID CENTERS | DISCREPANCY | BASIS-SETS | Benzene | Analysis | Bonds | Quantum theory
Journal Article