How far can one push the noble gases towards bonding?: a personal account
Noble gases (Ngs) are the least reactive elements in the periodic table towards chemical
bond formation when compared with other elements because of their completely filled …
bond formation when compared with other elements because of their completely filled …
Superhalogen doping: a new and effective approach to design materials with excellent static and dynamic NLO responses
Excess electron generation through doping with alkali and superalkali metals is well known
to enhance NLO responses. On the contrary, superhalogen doping is an unexplored …
to enhance NLO responses. On the contrary, superhalogen doping is an unexplored …
Structure, stability, reactivity and bonding in noble gas compounds
R Pal, PK Chattaraj - Physical Chemistry Chemical Physics, 2024 - pubs.rsc.org
Noble gases (Ngs) are recognized as the least reactive elements due to their fully filled
valence electronic configuration. Their reluctance to engage in chemical bond formation …
valence electronic configuration. Their reluctance to engage in chemical bond formation …
Chemical Aristocracy: He3 Dication and Analogous Noble-Gas-Exclusive Covalent Compounds
Herein, we predict the first set of covalently bonded triatomic molecular compounds
composed exclusively of noble gases. Using a combination of double-hybrid DFT, CCSD …
composed exclusively of noble gases. Using a combination of double-hybrid DFT, CCSD …
Exploring the Nature of Chemical Bonding between Noble Gases and Hypercoordinate Group 13 Compounds: Beyond Boron
R Báez-Grez, R Pino-Rios - The Journal of Physical Chemistry A, 2024 - ACS Publications
In this article, we systematically study the stability and chemical bond nature of EH4Ng+
compounds (E= Al–Tl; Ng= He–Rn) at the CCSD (T) and ωB97XD levels of theory …
compounds (E= Al–Tl; Ng= He–Rn) at the CCSD (T) and ωB97XD levels of theory …
Quantum chemical prediction of a superelectrophilic dianion and its binding with noble gas atoms
The present communication shows an unprecedented superelectrophilic behaviour of
dianion [BeB11 (CN) 11] 2−, containing a positively charged electrophilic center embedded …
dianion [BeB11 (CN) 11] 2−, containing a positively charged electrophilic center embedded …
Prediction of donor–acceptor-type novel noble gas complexes in the triplet electronic state
Closed-shell noble gas (Ng) compounds in the singlet electronic state have been
extensively studied in the past two decades after the revolutionary discovery of 1HArF …
extensively studied in the past two decades after the revolutionary discovery of 1HArF …
Exploring the viability of noble gas endohedral siladodecahedranes and its perhalogenated derivatives
Herein, a study of the thermodynamic and kinetic stability of compounds containing noble
gases (Ngs) encapsulated within the cage-like structure of recently synthesized …
gases (Ngs) encapsulated within the cage-like structure of recently synthesized …
Intriguing structural, bonding and reactivity features in some beryllium containing complexes
Although the toxicity of beryllium compounds causes impediments in experiments involving
them, beryllium chemistry has seen a recent upsurge of interest and considerable progress …
them, beryllium chemistry has seen a recent upsurge of interest and considerable progress …
Exploring the structure, bonding and stability of noble gas compounds promoted by superhalogens. A case study on HNgMX 3 (Ng= Ar–Rn, M= Be–Ca, X= F–Br) via …
LY Wu, JF Li, RF Zhao, L Luo, YC Wang… - Physical Chemistry …, 2019 - pubs.rsc.org
A series of complexes (HNgMX3), formed from superhalogen MX3 (M= Be–Ca, X= F–Br)
noble gas (Ar–Rn) and the hydrogen atom, were investigated via combined high-level ab …
noble gas (Ar–Rn) and the hydrogen atom, were investigated via combined high-level ab …