Published in Chem Soc Rev on June 10, 2015
Developing paradigms of chemical bonding: adaptive natural density partitioning. Phys Chem Chem Phys (2008) 1.43
Hepta- and octacoordinate boron in molecular wheels of eight- and nine-atom boron clusters: observation and confirmation. Angew Chem Int Ed Engl (2003) 1.14
Understanding boron through size-selected clusters: structure, chemical bonding, and fluxionality. Acc Chem Res (2014) 1.11
Theoretical study of hydrogenation of the doubly aromatic B7- cluster. J Mol Model (2005) 1.05
The induced magnetic field. Acc Chem Res (2011) 0.98
A photoelectron spectroscopic and theoretical study of B16- and B16(2-): an all-boron naphthalene. J Am Chem Soc (2008) 0.97
Revealing intuitively assessable chemical bonding patterns in organic aromatic molecules via adaptive natural density partitioning. J Org Chem (2008) 0.96
MX3(-) superhalogens (M = Be, Mg, Ca; X = Cl, Br): a photoelectron spectroscopic and ab initio theoretical study. J Phys Chem A (2005) 0.96
Structure of the Na(x)Cl(x+1) (-) (x=1-4) clusters via ab initio genetic algorithm and photoelectron spectroscopy. J Chem Phys (2004) 0.94
A concentric planar doubly π-aromatic B₁₉⁻ cluster. Nat Chem (2010) 0.93
Is Al2Cl6 aromatic? Cautions in superficial NICS interpretation. J Phys Chem A (2013) 0.91
Comprehensive analysis of chemical bonding in boron clusters. J Comput Chem (2007) 0.91
Deciphering chemical bonding in golden cages. J Phys Chem A (2009) 0.91
OH radical gas phase reactions with aliphatic ethers: a variational transition state theory study. J Phys Chem A (2009) 0.90
Global minimum structure searches via particle swarm optimization. J Comput Chem (2007) 0.89
Transition-metal-centered monocyclic boron wheel clusters (M©Bn): a new class of aromatic borometallic compounds. Acc Chem Res (2012) 0.88
The implications of symmetry of the external potential on bond paths. Chemistry (2008) 0.87
Influence of endohedral confinement on the electronic interaction between He atoms: a He2@C20H20 case study. Chemistry (2009) 0.87
Aromaticity and antiaromaticity in transition-metal systems. Phys Chem Chem Phys (2007) 0.87
Deciphering the mystery of hexagon holes in an all-boron graphene α-sheet. Phys Chem Chem Phys (2011) 0.86
Sandwich-like complexes based on "all-metal" (Al 4 2-) aromatic compounds. J Am Chem Soc (2004) 0.86
Lithium cluster anions: photoelectron spectroscopy and ab initio calculations. J Chem Phys (2011) 0.86
Inorganic double-helix structures of unusually simple lithium-phosphorus species. Angew Chem Int Ed Engl (2012) 0.85
A study of the coordination shell of aluminum(III) and magnesium(II) in model protein environments: thermodynamics of the complex formation and metal exchange reactions. J Inorg Biochem (2006) 0.85
Gold apes hydrogen. The structure and bonding in the planar B7Au2- and B7Au2 clusters. J Phys Chem A (2006) 0.84
All-metal antiaromatic molecule: rectangular Al4(4-) in the Li3Al4(-) anion. Science (2003) 0.84
Ab initio search for global minimum structures of the novel B3H(y) (y = 4-7) neutral and anionic clusters. Inorg Chem (2009) 0.84
Complexes between planar boron clusters and transition metals: a photoelectron spectroscopy and ab initio study of CoB12(-) and RhB12(-). J Phys Chem A (2014) 0.83
Solid state adaptive natural density partitioning: a tool for deciphering multi-center bonding in periodic systems. Phys Chem Chem Phys (2013) 0.83
Can an eight π-electron bare ring be planar? Phys Chem Chem Phys (2011) 0.83
Sn12(2-): stannaspherene. J Am Chem Soc (2006) 0.82
All-boron analogues of aromatic hydrocarbons: B17- and B18-. J Chem Phys (2011) 0.82
Sigma and pi contributions to the induced magnetic field: indicators for the mobility of electrons in molecules. J Comput Chem (2007) 0.82
A photoelectron spectroscopy and ab initio study of B21-: negatively charged boron clusters continue to be planar at 21. J Chem Phys (2012) 0.82
A combined photoelectron spectroscopy and ab initio study of the quasi-planar B24(-) cluster. J Chem Phys (2013) 0.82
Diradicals and diradicaloids in natural orbital functional theory. Chemphyschem (2011) 0.81
Molecular wheel B8(2-) as a new inorganic ligand. photoelectron spectroscopy and ab initio characterization of LiB8(-). Inorg Chem (2004) 0.81
Boron rings enclosing planar hypercoordinate group 14 elements. J Am Chem Soc (2007) 0.81
Activation of methane by the iron dimer cation. A theoretical study. J Phys Chem A (2006) 0.81
Structure and properties of ZnS nanoclusters. J Phys Chem B (2005) 0.81
A DFT/TDDFT study on the optoelectronic properties of the amine-capped magic (CdSe)13 nanocluster. Phys Chem Chem Phys (2013) 0.81
Bond paths show preferable interactions: ab initio and QTAIM studies on the X-H...pi hydrogen bond. J Phys Chem A (2010) 0.80
Planar tetracoordinate carbon in extended systems. J Am Chem Soc (2004) 0.80
Observation of the highest coordination number in planar species: decacoordinated Ta©B10(-) and Nb©B10(-) anions. Angew Chem Int Ed Engl (2012) 0.80
Sandwich complexes based on the "all-metal" Al4 2- aromatic ring. Chemistry (2006) 0.80
Natural orbital functional theory and reactivity studies of diradical rearrangements: ethylene torsion as a case study. Chemphyschem (2011) 0.80
Efficient evaluation of analytic Fukui functions. J Chem Phys (2008) 0.80
Photoelectron spectroscopy and ab initio study of the doubly antiaromatic B(6) (2-) dianion in the LiB(6) (-) cluster. J Chem Phys (2005) 0.80
CAl4Be and CAl3Be2(-): global minima with a planar pentacoordinate carbon atom. Chem Commun (Camb) (2010) 0.80
CB7-: experimental and theoretical evidence against hypercoordinate planar carbon. Angew Chem Int Ed Engl (2007) 0.80
Carbon avoids hypercoordination in CB6(-), CB6(2-), and C2B5(-) planar carbon-boron clusters. J Am Chem Soc (2008) 0.80
Aromatic metal-centered monocyclic boron rings: Co©B8- and Ru©B9-. Angew Chem Int Ed Engl (2011) 0.79
Transition-metal-centered nine-membered boron rings: MⓒB9 and MⓒB9(-) (M = Rh, Ir). J Am Chem Soc (2011) 0.79
Peculiar antiaromatic inorganic molecules of tetrapnictogen in Na+Pn4- (Pn = P, As, Sb) and important consequences for hydrocarbons. Inorg Chem (2002) 0.79
On the chemical bonding of gold in auro-boron oxide clusters AunBO- (n = 1-3). J Phys Chem A (2007) 0.79
Aromaticity of metallabenzenes and related compounds. Chem Soc Rev (2015) 0.79
Bonding, aromaticity, and structure of trigonal dianion metal clusters. J Comput Chem (2010) 0.79
Starlike aluminum-carbon aromatic species. Chemistry (2010) 0.78
Designing 3-D molecular stars. J Am Chem Soc (2009) 0.78
Experimental and theoretical investigation of three-dimensional nitrogen-doped aluminum clusters Al8N- and Al8N. J Chem Phys (2009) 0.78
A theoretical study of the principles regulating the specificity for Al(III) against Mg(II) in protein cavities. J Inorg Biochem (2007) 0.78
B22- and B23-: all-boron analogues of anthracene and phenanthrene. J Am Chem Soc (2012) 0.78
On the suppression mechanism of the pseudo-Jahn-Teller effect in middle E6 (E = P, As, Sb) rings of triple-decker sandwich complexes. Inorg Chem (2012) 0.78
B18(2-): a quasi-planar bowl member of the Wankel motor family. Chem Commun (Camb) (2014) 0.78
B19-: an aromatic Wankel motor. Angew Chem Int Ed Engl (2010) 0.78
An efficient grid-based scheme to compute QTAIM atomic properties without explicit calculation of zero-flux surfaces. J Comput Chem (2009) 0.78
The smallest and one of the brightest. Efficient preparation and optical description of the parent borondipyrromethene system. J Org Chem (2009) 0.78
Flattening a puckered cyclohexasilane ring by suppression of the pseudo-Jahn-Teller effect. J Chem Phys (2011) 0.78
Analysis of why boron avoids sp2 hybridization and classical structures in the BnHn+2 series. Chemistry (2012) 0.78
A reinterpretation of the nature of the Fermi hole. J Chem Phys (2004) 0.78
Two-dimensional Cu2Si monolayer with planar hexacoordinate copper and silicon bonding. J Am Chem Soc (2015) 0.78
Ab initio probing of the aromatic oxygen cluster O4(2+). J Phys Chem A (2005) 0.78
Stabilizing carbon-lithium stars. Phys Chem Chem Phys (2011) 0.78
δ-Bonding in the [Pd4(μ4-C9H9)(μ4-C8H8)]+ sandwich complex. Phys Chem Chem Phys (2010) 0.78
Self-assembling endohedrally doped CdS nanoclusters: new porous solid phases of CdS. Phys Chem Chem Phys (2012) 0.78
Planarity takes over in the C(x)H(x)P(6-x) (x = 0-6) series at x = 4. Phys Chem Chem Phys (2011) 0.78
Endohedral stannaspherenes Mn@Sn12 and its dimer: ferromagnetic or antiferromagnetic? Chemphyschem (2007) 0.78
A joint experimental and theoretical study of cation-pi interactions: multiple-decker sandwich complexes of ferrocene with alkali metal ions (Li+, Na+, K+, Rb+, Cs+). J Am Chem Soc (2005) 0.78
Thermally stable solids based on endohedrally doped ZnS clusters. Chemistry (2009) 0.78
Mono- and multidecker sandwich-like complexes of the tetraazacyclobutadiene aromatic ring. Angew Chem Int Ed Engl (2004) 0.77
Plane and simple: planar tetracoordinate carbon centers in small molecules. Phys Chem Chem Phys (2012) 0.77
In search of covalently bound tetra- and penta-oxygen species: a photoelectron spectroscopic and Ab initio investigation of MO4- and MO5- (M = Li, Na, K, Cs). J Am Chem Soc (2002) 0.77
Cu3C4-: a new sandwich molecule with two revolving C2(2-) units. J Phys Chem A (2005) 0.77
Unexpected trends in halogen-bond based noncovalent adducts. Chem Commun (Camb) (2012) 0.77
Stability of noble-gas-bound SiH₃⁺ clusters. Chemphyschem (2014) 0.77
Structure and stability of (NG)nCN3Be3(+) clusters and comparison with (NG)BeY(0/+). Chemphyschem (2013) 0.77
Unravelling phenomenon of internal rotation in B13+ through chemical bonding analysis. Chem Commun (Camb) (2011) 0.77
The I=X (X=O,N,C) double bond in hypervalent iodine compounds: is it real? Angew Chem Int Ed Engl (2014) 0.77
Ab initio study on the stability of Ng(n)Be₂N₂, Ng(n)Be₃N₂ and NgBeSiN₂ clusters. Chemphyschem (2014) 0.77
Planar tetracoordinate carbon versus planar tetracoordinate boron: the case of CB4 and its cation. J Am Chem Soc (2011) 0.77
Ab initio structure of the (Na(2)[CAl(4)])(2) dimer. Next step toward solid materials containing tetracoordinate planar carbon. Inorg Chem (2002) 0.77
Appraisal of the performance of nonhybrid density functional methods in characterization of the Al4C molecule. J Chem Phys (2005) 0.77
Experimental and theoretical investigations of CB8-: towards rational design of hypercoordinated planar chemical species. Phys Chem Chem Phys (2009) 0.76
Al(6)(2-) - fusion of two aromatic Al(3)(-) units. A combined photoelectron spectroscopy and ab initio study of M(+)[Al(6)(2-)] (M = Li, Na, K, Cu, and Au). J Am Chem Soc (2002) 0.76
Planar tetracoordinate carbons in cyclic hydrocarbons. Org Lett (2005) 0.76
Planar to linear structural transition in small boron-carbon mixed clusters: C(x)B(5-x)- (x = 1-5). J Am Chem Soc (2010) 0.76
Bonding analysis of planar hypercoordinate atoms via the generalized BLW-LOL. J Comput Chem (2013) 0.76