London dispersion forces in sterically crowded inorganic and organometallic molecules

Dispersion-Force-Assisted Disproportionation: A Stable Two-Coordinate Copper(II) Complex

(2016) Clifton L. Wagner et al.   ANGEWANDTE CHEMIE-INTERNATIONAL EDITION

Dispersion Forces, Disproportionation, and Stable High-Valent Late Transition Metal Alkyls

(2016) David J. Liptrot et al.   ANGEWANDTE CHEMIE-INTERNATIONAL EDITION

Dispersion-Corrected Mean-Field Electronic Structure Methods

(2016) Stefan Grimme et al.   CHEMICAL REVIEWS

Experimental Binding Energies in Supramolecular Complexes

(2016) Frank Biedermann et al.   CHEMICAL REVIEWS

A three-coordinate iron–silylene complex stabilized by ligand–ligand dispersion forces

(2016) Mikko M. Hänninen et al.   DALTON TRANSACTIONS

Dispersion-Energy-Driven Wagner–Meerwein Rearrangements in Oligosilanes

(2016) Lena Albers et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

The Instability of Ni{N(SiMe3)2}2: A Fifty Year Old Transition Metal Silylamide Mystery

(2015) Michelle Faust et al.   ANGEWANDTE CHEMIE-INTERNATIONAL EDITION

London Dispersion in Molecular Chemistry-Reconsidering Steric Effects

(2015) J. Philipp Wagner et al.   ANGEWANDTE CHEMIE-INTERNATIONAL EDITION

Homopolar dihydrogen bonding in main group hydrides: discovery, consequences, and applications

(2015) David J. Wolstenholme et al.   DALTON TRANSACTIONS

London Dispersion Decisively Contributes to the Thermodynamic Stability of Bulky NHC-Coordinated Main Group Compounds

(2015) J. Philipp Wagner et al.   Journal of Chemical Theory and Computation

Dispersion Force Effects on the Dissociation of “Jack-in-the-Box” Diphosphanes and Diarsanes

(2015) Jing-Dong Guo et al.   ORGANOMETALLICS

van der Waals forces in density functional theory: a review of the vdW-DF method

(2015) Kristian Berland et al.   REPORTS ON PROGRESS IN PHYSICS

The multiple bonding in heavier group 14 element alkene analogues is stabilized mainly by dispersion force effects

(2015) Jing-Dong Guo et al.   Chemical Science

Role of Steric Attraction and Bite-Angle Flexibility in Metal-Mediated C–H Bond Activation

(2015) Lando P. Wolters et al.   ACS Catalysis

Understanding Molecular Crystals with Dispersion-Inclusive Density Functional Theory: Pairwise Corrections and Beyond

(2014) Leeor Kronik et al.   ACCOUNTS OF CHEMICAL RESEARCH

Non-Nuclear Attractor in a Molecular Compound under External Pressure

(2014) Lai-Chin Wu et al.   EUROPEAN JOURNAL OF INORGANIC CHEMISTRY

Forces stabilizing proteins

(2014) C. Nick Pace et al.   FEBS LETTERS

Low-Cost Quantum Chemical Methods for Noncovalent Interactions

(2014) Jan Gerit Brandenburg et al.   Journal of Physical Chemistry Letters

Stability and electronic structures of substituted tetrahedranes, silicon and germanium parents – a DFT, ADMP, QTAIM and GVB study

(2014) Norberto K. V. Monteiro et al.   NEW JOURNAL OF CHEMISTRY

Dispersion Makes the Difference: Bisligated Transition States Found for the Oxidative Addition of Pd(PtBu3)2 to Ar-OSO2R and Dispersion-Controlled Chemoselectivity in Reactions with Pd[P(iPr)(tBu2)]2

(2014) Eirik Lyngvi et al.   ORGANOMETALLICS

The Thermochemistry of London Dispersion-Driven Transition Metal Reactions: Getting the ‘Right Answer for the Right Reason’

(2014) Andreas Hansen et al.   ChemistryOpen

Reactivity and Mössbauer Spectroscopic Characterization of an Fe(IV) Ketimide Complex and Reinvestigation of an Fe(IV) Norbornyl Complex

(2013) Richard A. Lewis et al.   INORGANIC CHEMISTRY

Dispersion Force Stabilized Two-Coordinate Transition Metal–Amido Complexes of the −N(SiMe3)Dipp (Dipp = C6H3-2,6-Pri2) Ligand: Structural, Spectroscopic, Magnetic, and Computational Studies

(2013) Chun-Yi Lin et al.   INORGANIC CHEMISTRY

Role Played by Isopropyl Substituents in Stabilizing the Putative Triple Bond in Ar′EEAr′ [E = Si, Ge, Sn; Ar′ = C6H3-2,6-(C6H3-2,6-Pri2)2] and Ar*PbPbAr* [Ar* = C6H3-2,6-(C6H2-2,4,6-Pri3)2]

(2013) Issaka Seidu et al.   INORGANIC CHEMISTRY

Linear and Nonlinear Two-Coordinate Vanadium Complexes: Synthesis, Characterization, and Magnetic Properties of V(II) Amides

(2013) Jessica N. Boynton et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

Dispersion Forces and Counterintuitive Steric Effects in Main Group Molecules: Heavier Group 14 (Si–Pb) Dichalcogenolate Carbene Analogues with Sub-90° Interligand Bond Angles

(2013) Brian D. Rekken et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

How much do van der Waals dispersion forces contribute to molecular recognition in solution?

(2013) Lixu Yang et al.   Nature Chemistry

The Development of Bulky Palladium NHC Complexes for the Most-Challenging Cross-Coupling Reactions

(2012) Cory Valente et al.   ANGEWANDTE CHEMIE-INTERNATIONAL EDITION

Stable Two-Coordinate, Open-Shell (d1–d9) Transition Metal Complexes

(2012) Philip P. Power   CHEMICAL REVIEWS

The accuracy of DFT-optimized geometries of functional transition metal compounds: a validation study of catalysts for olefin metathesis and other reactions in the homogeneous phase

(2012) Yury Minenkov et al.   DALTON TRANSACTIONS

Analysis of the Putative Cr–Cr Quintuple Bond in Ar′CrCrAr′ (Ar′ = C6H3-2,6(C6H3-2,6-Pri2)2 Based on the Combined Natural Orbitals for Chemical Valence and Extended Transition State Method

(2012) Sylvester Ndambuki et al.   INORGANIC CHEMISTRY

Dispersion Energy Enforced Dimerization of a Cyclic Disilylated Plumbylene

(2012) Henning Arp et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

Stable Alkanes Containing Very Long Carbon–Carbon Bonds

(2012) Andrey A. Fokin et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

Dispersion and Back-Donation Gives Tetracoordinate [Pd(PPh3)4]

(2011) Mårten S. G. Ahlquist et al.   ANGEWANDTE CHEMIE-INTERNATIONAL EDITION

Steric Crowding Can Stabilize a Labile Molecule: Solving the Hexaphenylethane Riddle

(2011) Stefan Grimme et al.   ANGEWANDTE CHEMIE-INTERNATIONAL EDITION

Does DFT-D estimate accurate energies for the binding of ligands to metal complexes?

(2011) Ulf Ryde et al.   DALTON TRANSACTIONS

Organometallic reactivity: the role of metal–ligand bond energies from a computational perspective

(2011) Natalie Fey et al.   DALTON TRANSACTIONS

The Nature of the Barrier to Phosphane Dissociation from Grubbs Olefin Metathesis Catalysts

(2011) Yury Minenkov et al.   EUROPEAN JOURNAL OF INORGANIC CHEMISTRY

A simple but fully nonlocal correction to the random phase approximation

(2011) Adrienn Ruzsinszky et al.   JOURNAL OF CHEMICAL PHYSICS

Overcoming lability of extremely long alkane carbon–carbon bonds through dispersion forces

(2011) Peter R. Schreiner et al.   NATURE

Dihydrogen contacts in alkanes are subtle but not faint

(2011) Jorge Echeverría et al.   Nature Chemistry

Johannes Diderik van der Waals: A Pioneer in the Molecular Sciences and Nobel Prize Winner in 1910

(2010) Kwong-Tin Tang et al.   ANGEWANDTE CHEMIE-INTERNATIONAL EDITION

Applications and validations of the Minnesota density functionals

(2010) Yan Zhao et al.   CHEMICAL PHYSICS LETTERS

π-Bonding and the Lone Pair Effect in Multiple Bonds Involving Heavier Main Group Elements: Developments in the New Millennium

(2010) Roland C. Fischer et al.   CHEMICAL REVIEWS

N-Heterocyclic Carbene Analogues with Low-Valent Group 13 and Group 14 Elements: Syntheses, Structures, and Reactivities of a New Generation of Multitalented Ligands†

(2010) Matthew Asay et al.   CHEMICAL REVIEWS

Fast computation of molecular random phase approximation correlation energies using resolution of the identity and imaginary frequency integration

(2010) Henk Eshuis et al.   JOURNAL OF CHEMICAL PHYSICS

Inter- and intramolecular dispersion interactions

(2010) Marcel Swart et al.   JOURNAL OF COMPUTATIONAL CHEMISTRY

Substituent effects in ditetrel alkyne analogues: multiple vs. single bonded isomers

(2010) Yang Peng et al.   Chemical Science

Bulky guanidinates for the stabilization of low oxidation state metallacycles

(2009) Cameron Jones   COORDINATION CHEMISTRY REVIEWS

A Combined Charge and Energy Decomposition Scheme for Bond Analysis

(2009) Mariusz P. Mitoraj et al.   Journal of Chemical Theory and Computation

Evaluation of Range-Separated Hybrid and Other Density Functional Approaches on Test Sets Relevant for Transition Metal-Based Homogeneous Catalysts†

(2009) Carlos A. Jiménez-Hoyos et al.   JOURNAL OF PHYSICAL CHEMISTRY A

Density Functionals with Broad Applicability in Chemistry

(2008) Yan Zhao et al.   ACCOUNTS OF CHEMICAL RESEARCH

Remarkable Stability of Metallocenes with Superbulky Ligands: Spontaneous Reduction of SmIII to SmII

(2008) Christian Ruspic et al.   ANGEWANDTE CHEMIE-INTERNATIONAL EDITION

Molecular Single-Bond Covalent Radii for Elements 1-118

(2008) Pekka Pyykkö et al.   CHEMISTRY-A EUROPEAN JOURNAL

Diamonds are a Chemist's Best Friend: Diamondoid Chemistry Beyond Adamantane

(2007) Hartmut Schwertfeger et al.   ANGEWANDTE CHEMIE-INTERNATIONAL EDITION