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#TitleJournalYearCitations
1A New Zirconium Inorganic Building Brick Forming Metal Organic Frameworks with Exceptional StabilityJournal of the American Chemical Society20085,478
2Organic aerosol and global climate modelling: a reviewAtmospheric Chemistry and Physics20052,947
3Basis-set convergence of correlated calculations on waterJournal of Chemical Physics19972,197
4Basis-set convergence in correlated calculations on Ne, N2, and H2OChemical Physics Letters19981,989
5Synthesis and Stability of Tagged UiO-66 Zr-MOFsChemistry of Materials20101,547
6Conversion of Methanol to Hydrocarbons: How Zeolite Cavity and Pore Size Controls Product SelectivityAngewandte Chemie - International Edition20121,476
7Disclosing the Complex Structure of UiO-66 Metal Organic Framework: A Synergic Combination of Experiment and TheoryChemistry of Materials20111,420
8Ab Initio Methods for the Calculation of NMR Shielding and Indirect Spin−Spin Coupling ConstantsChemical Reviews19991,318
9Molcas 8: New capabilities for multiconfigurational quantum chemical calculations across the periodic tableJournal of Computational Chemistry20161,317
10The Dalton quantum chemistry program systemWiley Interdisciplinary Reviews: Computational Molecular Science20141,166
11The complete active space SCF (CASSCF) method in a Newton–Raphson formulation with application to the HNO moleculeJournal of Chemical Physics1981982
12Defect Engineering: Tuning the Porosity and Composition of the Metal–Organic Framework UiO-66 via Modulated SynthesisChemistry of Materials2016933
13Conversion of methanol to hydrocarbons over zeolite H-ZSM-5: On the origin of the olefinic speciesJournal of Catalysis2007893
14Solid-state protonic conductors: principles, properties, progress and prospectsSolid State Ionics1999747
15Mechanistic Aspects of C−H Activation by Pt ComplexesChemical Reviews2005719
16Principles for a directSCFapproach toLICAO-MOab-initiocalculationsJournal of Computational Chemistry1982670
17Tuned to Perfection: Ironing Out the Defects in Metal–Organic Framework UiO-66Chemistry of Materials2014634
18Basis-set convergence of the energy in molecular Hartree–Fock calculationsChemical Physics Letters1999604
19Hydrogen adsorption in a nickel based coordination polymer with open metal sites in the cylindrical cavities of the desolvated frameworkChemical Communications2006596
20On the Reaction Mechanism for Hydrocarbon Formation from Methanol over SAPO-34Journal of Catalysis1996585
21Theoretical investigation of magnetoelectric behavior inBiFeO3Physical Review B2006582
22The Inconsistency in Adsorption Properties and Powder XRD Data of MOF-5 Is Rationalized by Framework Interpenetration and the Presence of Organic and Inorganic Species in the NanocavitiesJournal of the American Chemical Society2007575
23An overview of the methods used in the characterisation of natural organic matter (NOM) in relation to drinking water treatmentChemosphere2011549
24Recent Advances in Wave Function-Based Methods of Molecular-Property CalculationsChemical Reviews2012549
25Excitation energies from the coupled cluster singles and doubles linear response function (CCSDLR). Applications to Be, CH+, CO, and H2OJournal of Chemical Physics1990529
26On the reaction mechanism for propene formation in the MTO reaction over SAPO-34Catalysis Letters1993529
27An In Situ High-Temperature Single-Crystal Investigation of a Dehydrated Metal-Organic Framework Compound and Field-Induced Magnetization of One-Dimensional Metal-Oxygen ChainsAngewandte Chemie - International Edition2005528
28Proton conduction in rare-earth ortho-niobates and ortho-tantalatesNature Materials2006457
29Electronic and vibrational properties of a MOF-5 metal–organic framework: ZnO quantum dot behaviourChemical Communications2004445
30Assessment of a Coulomb-attenuated exchange–correlation energy functionalPhysical Chemistry Chemical Physics2006437
31Nanotube Formation by Hydrophobic DipeptidesChemistry - A European Journal2001433
32Methanol to gasoline over zeolite H-ZSM-5: Improved catalyst performance by treatment with NaOHApplied Catalysis A: General2008433
33α-Particle Radiotherapy with 211At-Labeled Monodisperse Polymer Particles, 211At-Labeled IgG Proteins, and Free 211At in a Murine Intraperitoneal Tumor ModelGynecologic Oncology1995429
34H2storage in isostructural UiO-67 and UiO-66 MOFsPhysical Chemistry Chemical Physics2012415
35The CC3 model: An iterative coupled cluster approach including connected triplesJournal of Chemical Physics1997412
36In Inland China, Rice, Rather than Fish, Is the Major Pathway for Methylmercury ExposureEnvironmental Health Perspectives2010412
37Self-assembly of spider silk proteins is controlled by a pH-sensitive relayNature2010393
38Global warming potentials and radiative efficiencies of halocarbons and related compounds: A comprehensive reviewReviews of Geophysics2013390
39The structure of nanotubes formed by diphenylalanine, the core recognition motif of Alzheimer's β-amyloid polypeptideChemical Communications2006385
40Basis set convergence of the interaction energy of hydrogen-bonded complexesJournal of Chemical Physics1999363
41Density-functional theory of linear and nonlinear time-dependent molecular propertiesJournal of Chemical Physics2002359
42The accurate determination of molecular equilibrium structuresJournal of Chemical Physics2001353
43Adsorption properties and structure of CO2 adsorbed on open coordination sites of metal–organic framework Ni2(dhtp) from gas adsorption, IR spectroscopy and X-ray diffractionChemical Communications2008348
44A comparison study on Raman scattering properties of α- and β-MnO2Analytica Chimica Acta2009347
45Product shape selectivity dominates the Methanol-to-Olefins (MTO) reaction over H-SAPO-34 catalystsJournal of Catalysis2009344
46Hydrogen in oxidesDalton Transactions2004342
47Direct conversion of methane to aromatics in a catalytic co-ionic membrane reactorScience2016341
48Post-synthetic modification of the metal–organic framework compound UiO-66Journal of Materials Chemistry2010340
49The prediction of molecular equilibrium structures by the standard electronic wave functionsJournal of Chemical Physics1997333
50The Reactivity of Molecules Trapped within the SAPO-34 Cavities in the Methanol-to-Hydrocarbons ReactionJournal of the American Chemical Society2001330