Related references
Note: Only part of the references are listed.A test of ab initio-generated, radial intermolecular potential energy functions for five axially-symmetric, hydrogen-bonded complexes BMIDLINE HORIZONTAL ELLIPSISHF, where B = N2, CO, PH3, HCN and NH3
Anthony C. Legon
PHYSICAL CHEMISTRY CHEMICAL PHYSICS (2021)
Strengths of non-covalent interactions in hydrogen-bonded complexes B•••HX and halogen-bonded complexes B•••XY (X, Y = F, Cl): an ab initio investigation
Ibon Alkorta et al.
NEW JOURNAL OF CHEMISTRY (2018)
Halogen Bonding with Phosphine: Evidence for Mulliken Inner Complexes and the Importance of Relaxation Energy
Robert A. Shaw et al.
JOURNAL OF PHYSICAL CHEMISTRY A (2016)
A reduced radial potential energy function for the halogen bond and the hydrogen bond in complexes B•••XY and B•••HX, where X and Y are halogen atoms (vol 16, pg 12415, 2014)
Anthony C. Legon
PHYSICAL CHEMISTRY CHEMICAL PHYSICS (2014)
Accurate first principles calculations on chlorine fluoride ClF and its ions ClF±
Athanassios A. Vassilakis et al.
THEORETICAL CHEMISTRY ACCOUNTS (2014)
Definition of the halogen bond (IUPAC Recommendations 2013)
Gautam R. Desiraju et al.
PURE AND APPLIED CHEMISTRY (2013)
Study of the vibrational characteristics of the homonuclear diatomic nuclear schrodinger equation with a numerov method using a number of empirical potential functions
Alireza Heidari et al.
RUSSIAN JOURNAL OF PHYSICAL CHEMISTRY A (2013)
Explicitly Correlated Electrons in Molecules
Christof Haettig et al.
CHEMICAL REVIEWS (2012)
Molpro: a general-purpose quantum chemistry program package
Hans-Joachim Werner et al.
WILEY INTERDISCIPLINARY REVIEWS-COMPUTATIONAL MOLECULAR SCIENCE (2012)
Defining the hydrogen bond: An account (IUPAC Technical Report)
Elangannan Arunan et al.
PURE AND APPLIED CHEMISTRY (2011)
Communications: Accurate and efficient approximations to explicitly correlated coupled-cluster singles and doubles, CCSD-F12
Christof Haettig et al.
JOURNAL OF CHEMICAL PHYSICS (2010)
Correlation consistent basis sets for molecular core-valence effects with explicitly correlated wave functions: The atoms B-Ne and Al-Ar
J. Grant Hill et al.
JOURNAL OF CHEMICAL PHYSICS (2010)
Halogen bonding based recognition processes: A world parallel to hydrogen bonding
P Metrangolo et al.
ACCOUNTS OF CHEMICAL RESEARCH (2005)
Share Paper
