Published in Phys Chem Chem Phys on July 03, 2008
A stable compound of helium and sodium at high pressure. Nat Chem (2017) 1.07
A concentric planar doubly π-aromatic B₁₉⁻ cluster. Nat Chem (2010) 0.93
Dynamical behavior of Borospherene: A Nanobubble. Sci Rep (2015) 0.90
Cobalt-centred boron molecular drums with the highest coordination number in the CoB16(-) cluster. Nat Commun (2015) 0.80
Simultaneous Visualization of Covalent and Noncovalent Interactions Using Regions of Density Overlap. J Chem Theory Comput (2014) 0.79
Density functional theory study of small nickel clusters. J Mol Model (2011) 0.79
Planar π-aromatic C3h B6H(3)(+) and π-antiaromatic C2h B8H2: boron hydride analogues of D3h C3H(3)(+) and D2h C4H4. J Mol Model (2012) 0.77
Computational investigation on MB n (M = Li-Cs, Be-Ba, Sc-La and Ti; n = 28 and 38). J Mol Model (2016) 0.76
Competition between drum and quasi-planar structures in RhB18(-): motifs for metallo-boronanotubes and metallo-borophenes. Chem Sci (2016) 0.75
Infrared spectroscopic and theoretical study of the HC2n+1O(+) (n = 2-5) cations. J Chem Phys (2017) 0.75
From Quasi-Planar B56 to Penta-Ring Tubular Ca©B56: Prediction of Metal-Stabilized Ca©B56 as the Embryo of Metal-Doped Boron α-Nanotubes. Sci Rep (2016) 0.75
Revisiting Aromaticity and Chemical Bonding of Fluorinated Benzene Derivatives. ChemistryOpen (2015) 0.75
A grand unified model for liganded gold clusters. Nat Commun (2016) 0.75
Insights into the geometries, electronic and magnetic properties of neutral and charged palladium clusters. Sci Rep (2016) 0.75
Double C-H bond activation of acetylene by atomic boron in forming aromatic cyclic-HBC2BH in solid neon. Chem Sci (2017) 0.75
Effect of Alkali Metal Atoms Doping on Structural and Nonlinear Optical Properties of the Gold-Germanium Bimetallic Clusters. Nanomaterials (Basel) (2017) 0.75
Preparation and characterization of chemically bonded argon-boroxol ring cation complexes. Chem Sci (2017) 0.75
B2(BO)6 0/- and B 2(BS) 6 0/- doubly bridged structures containing BO or BS as ligands. J Mol Model (2014) 0.75
D2BIA-flexible, not (explicitly) arbitrary and reference/structurally invariant-a very effective and improved version of the D3BIA aromaticity index. J Mol Model (2017) 0.75
B30H8, B39H9(2-), B42H10, B48H10, and B72H12: polycyclic aromatic snub hydroboron clusters analogous to polycyclic aromatic hydrocarbons. J Mol Model (2012) 0.75
First-Principles Study of Structural, Electronic and Magnetic Properties of Metal-Centered Tetrahexahedral V15⁺ Cluster. Nanomaterials (Basel) (2017) 0.75
First-principle investigation on growth patterns and properties of cobalt-doped lithium nanoclusters. J Mol Model (2016) 0.75
An insight into the structures, stabilities, and bond character of B(n)Pt (n=1∼6) clusters. J Mol Model (2014) 0.75
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
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
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
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
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
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
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
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
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
Molecular wheel B8(2-) as a new inorganic ligand. photoelectron spectroscopy and ab initio characterization of LiB8(-). Inorg Chem (2004) 0.81
Observation of the highest coordination number in planar species: decacoordinated Ta©B10(-) and Nb©B10(-) anions. Angew Chem Int Ed Engl (2012) 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
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
Experimental and theoretical investigation of three-dimensional nitrogen-doped aluminum clusters Al8N- and Al8N. J Chem Phys (2009) 0.78
Analysis of why boron avoids sp2 hybridization and classical structures in the BnHn+2 series. Chemistry (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
Flattening a puckered cyclohexasilane ring by suppression of the pseudo-Jahn-Teller effect. J Chem Phys (2011) 0.78
B22- and B23-: all-boron analogues of anthracene and phenanthrene. J Am Chem Soc (2012) 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
δ-Bonding in the [Pd4(μ4-C9H9)(μ4-C8H8)]+ sandwich complex. Phys Chem Chem Phys (2010) 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
Cu3C4-: a new sandwich molecule with two revolving C2(2-) units. J Phys Chem A (2005) 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
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
Appraisal of the performance of nonhybrid density functional methods in characterization of the Al4C molecule. J Chem Phys (2005) 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
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 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
Revealing unusual chemical bonding in planar hyper-coordinate Ni2Ge and quasi-planar Ni2Si two-dimensional crystals. Phys Chem Chem Phys (2015) 0.76
Post-anti-van't Hoff-Le Bel motif in atomically thin germanium-copper alloy film. Phys Chem Chem Phys (2015) 0.76
Recent developments and future prospects of all-metal aromatic compounds. Chem Soc Rev (2015) 0.75
Comment on "Instability of the Al4(2-) 'all-metal aromatic' ion and its implications". J Phys Chem A (2008) 0.75
Deciphering aromaticity in porphyrinoids via adaptive natural density partitioning. Org Biomol Chem (2014) 0.75
Molecular wheel to monocyclic ring transition in boron-carbon mixed clusters C2B6⁻ and C3B5⁻. Phys Chem Chem Phys (2011) 0.75
On the way to the highest coordination number in the planar metal-centred aromatic Ta©B10- cluster: evolution of the structures of TaB(n)- (n = 3-8). J Chem Phys (2013) 0.75
Stabilization of a Cl(-)-Cl(-) anion pair in the gas phase: ab initio microsolvation study. J Phys Chem A (2014) 0.75
Reliable predictions of unusual molecules. Phys Chem Chem Phys (2012) 0.75
Long-range magnetic response of toroidal boron structures: B16 and [Co@B16](-/3-) species. Phys Chem Chem Phys (2017) 0.75
Delta aromaticity in [Ta3O3]-. Angew Chem Int Ed Engl (2007) 0.75
Photoelectron spectroscopy of cold hydrated sulfate clusters, SO4(2-)(H2O)n (n = 4-7): temperature-dependent isomer populations. J Phys Chem A (2009) 0.75
Valence isoelectronic substitution in the B8(-) and B9(-) molecular wheels by an Al dopant atom: umbrella-like structures of AlB7(-) and AlB8(-). J Chem Phys (2011) 0.75
Flattening the b(6)h(6)(2-) octahedron Ab initio prediction of a new family of planar all-boron aromatic molecules. J Am Chem Soc (2003) 0.75
Ozonic acid and its ionic salts: ab initio probing of the O(4)(2)(-) dianion. Inorg Chem (2004) 0.75
Aluminum avoids the central position in AlB9- and AlB10-: photoelectron spectroscopy and ab initio study. J Phys Chem A (2011) 0.75
Arachno, nido, and closo aromatic isomers of the Li6B6H6 molecule. Inorg Chem (2004) 0.75
Aluminum chain in Li2Al3H8(-) as suggested by photoelectron spectroscopy and ab initio calculations. Phys Chem Chem Phys (2015) 0.75
"Benzation" of graphene upon addition of monovalent chemical species. Phys Chem Chem Phys (2013) 0.75
All-nitrogen analogue of ozone: Li₃N₃ species. Chemistry (2014) 0.75
Multiple aromaticity and antiaromaticity in silicon clusters. Chemphyschem (2004) 0.75
Geometric and electronic factors in the rational design of transition-metal-centered boron molecular wheels. J Chem Phys (2013) 0.75
Probing the structure and bonding in Al6N- and Al6N by photoelectron spectroscopy and ab initio calculations. J Phys Chem A (2007) 0.75
Assessing the viability of extended nonmetal atom chains in M(n)F(4n+2) (M=S and Se). Angew Chem Int Ed Engl (2014) 0.75
Negative electron binding energies observed in a triply charged anion: photoelectron spectroscopy of 1-hydroxy-3,6,8-pyrene-trisulfonate. J Chem Phys (2008) 0.75
Homocatenation of aluminum: alkane-like structures of Li2Al2H6 and Li3Al3H8. Chemistry (2015) 0.75
Planar nitrogen-doped aluminum clusters AlxN- (x=3-5). J Chem Phys (2006) 0.75
On the structure and chemical bonding of Si6(2-) and Si6(2-) in NaSi6(-) upon Na+ coordination. J Chem Phys (2006) 0.75
Photoelectron spectroscopy and Ab initio study of the structure and bonding of Al7N- and Al7N. J Phys Chem A (2008) 0.75
Structural changes in the series of boron-carbon mixed clusters C(x)B(10-x)- (x = 3-10) upon substitution of boron by carbon. J Chem Phys (2013) 0.75
Probing the electronic stability of multiply charged anions: sulfonated pyrene tri- and tetraanions. J Am Chem Soc (2009) 0.75
Observation of triatomic species with conflicting aromaticity: AlSi2- and AlGe2-. J Phys Chem B (2006) 0.75
Inorganic double-helix nanotoroid of simple lithium-phosphorus species. Chemistry (2014) 0.75
Chemical bonding in Si5(2-) and NaSi5(-) via photoelectron spectroscopy and ab initio calculations. J Phys Chem A (2005) 0.75
Photoelectron spectroscopy and ab initio study of boron-carbon mixed clusters: CB9- and C2B8-. J Chem Phys (2012) 0.75
Homocatenation of aluminum: alkane-like structures of Li2Al2 H6 and Li3Al3H8. Chemistry (2015) 0.75
Peculiar transformation of a nonaromatic Al(4)Cl(4)(NH(3))(4) into an aromatic Na(2)Al(4)Cl(4)(NH(3))(4). Inorg Chem (2002) 0.75
Si(6-n)C(n)H6 (n = 0-6) series: when do silabenzenes become planar and global minima? J Phys Chem A (2012) 0.75
Hf3 cluster is triply (sigma-, pi-, and delta-) aromatic in the lowest D3h, 1A1' state. J Phys Chem A (2007) 0.75
The oxygen-rich carboxide series: COn (n = 3, 4, 5, 6, 7, or 8). J Phys Chem A (2005) 0.75
Theoretical probing of deltahedral closo-auroboranes B(x)Au(x)2- (x = 5-12). Inorg Chem (2006) 0.75
Chemical bonding and aromaticity in trinuclear transition-metal halide clusters. Inorg Chem (2010) 0.75
Planarization of B7- and B12- clusters by isoelectronic substitution: AlB6- and AlB11-. J Am Chem Soc (2011) 0.75
Ab initio study of lithiathion of the Si4(-) cluster. J Phys Chem A (2011) 0.75
Combined experimental and theoretical investigation of three-dimensional, nitrogen-doped, gallium cluster anions. J Phys Chem A (2010) 0.75