205
Articles
5K
Citations
2.1
avg. Impact Factor
36
h-index

Most Cited Articles of Department of Inorganic Chemistry

TitleJournalYearCitations
Prescription for the design and selection of density functional approximations: more constraint satisfaction with fewer fitsJournal of Chemical Physics2005658
Aromaticity of phosphorus heterocyclesChemical Reviews2001333
Density functionals that are one- and two- are not always many-electron self-interaction-free, as shown for H2+, He2+, LiH+, and Ne2+Journal of Chemical Physics2007248
From model compounds to extended pi-conjugated systems: synthesis and properties of dithieno[3,2-b:2',3'-d]phospholesChemistry - A European Journal2005154
Dibenzophosphapentaphenes: exploiting P chemistry for gap fine-tuning and coordination-driven assembly of planar polycyclic aromatic hydrocarbonsJournal of the American Chemical Society2012126
Scaling down the Perdew-Zunger self-interaction correction in many-electron regionsJournal of Chemical Physics2006108
Connecting pi-chromophores by sigma-P-P bonds: new type of assemblies exhibiting sigma-pi-conjugationJournal of the American Chemical Society200488
Proper basis set for quantum mechanical studies of potential energy surfaces of carbohydratesComputational and Theoretical Chemistry200287
1-(2,4,6-Tri-tert-butylphenyl)-3-methylphosphole:  A Phosphole with a Significantly Flattened Phosphorus Pyramid Having Pronounced Characteristics of AromaticityJournal of the American Chemical Society199784
Relative stability of 1C4 and 4C1 chair forms of β-d-glucose: a density functional studyChemical Physics Letters199678
Synthesis and structure of a 1,3-diphosphacyclobutadienediide: an aniomesolytic fragmentation of a 1,3-diphosphetane-2,4-diyl in solutionAngewandte Chemie - International Edition200472
Aromatic Compounds with Planar Tricoordinate PhosphorusTetrahedron200065
Energies of organic molecules and atoms in density functional theoryInternational Journal of Quantum Chemistry200562
An aromatic-antiaromatic switch in P-heteroles. A small change in delocalisation makes a big reactivity differenceOrganic and Biomolecular Chemistry200660
Inclusion of exact exchange for self-interaction corrected H3 density functional potential energy surfaceTheoretical Chemistry Accounts199859
Transition Metal Complexes of N-Heterocyclic GermylenesEuropean Journal of Inorganic Chemistry200955
Nature of Bonding in Cyclic Conjugated YlidesThe Journal of Physical Chemistry199648
The First Delocalized Phosphole Containing a Planar Tricoordinate Phosphorus Atom: 1-[Bis(trimethylsilyl)methyl]-3,5-bis(trimethylsilyl)-1,2,4-triphospholeAngewandte Chemie - International Edition199846
Toward a Planar σ3-PhosphorusThe Journal of Physical Chemistry199646
Synthesis, electronic properties and WOLED devices of planar phosphorus-containing polycyclic aromatic hydrocarbonsChemistry - A European Journal201545
Effect of the π-π stacking interaction on the acidity of phenolChemical Physics Letters200545
Analysis of the core-repulsion functions used in AM1 and PM3 semiempirical calculations: Conformational analysis of ring systemsJournal of Computational Chemistry199345
The mechanism of 1,2-addition of disilene and silene. 1. Water and alcohol additionJournal of the American Chemical Society200144
Stability of phosphinidenes--are they synthetically accessible?Dalton Transactions200643
Estimation, computation, and experimental correction of molecular zero-point vibrational energiesJournal of Physical Chemistry A200542