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Chemistry
04/2005 Detection and quantification of Pu(III, IV, V, and VI) using a 1.0-meter liquid core waveguide
04/2005 Single-crystal-to-single-crystal [2 + 2] photodimerizations: from discovery to design
04/2005 Hybrid twinning – a cooperative type of oriented crystal association
04/2005 Neptunium(IV) complexation by humic substances studied by X-ray absorption fine structure spectroscopy
04/2005 Influence of the nutritional mechanism of fungi (mycorrhize/saprophyte) on the uptake of radionuclides by mycelium
04/2005 Characterization of Sr2+ uptake on natural minerals of kaolinite and magnesite using XRPD, SEM/EDS, XPS, and DRIFT
04/2005 Catechol functionalized aminopropyl silica gel: synthesis, characterization and preconcentrative separation of uranium(VI) from thorium(IV)
04/2005 Release of contaminant U(VI) from soils
04/2005 Empirical relation between the adsorption properties of elements on gold surfaces and their volatility
04/2005 Ultrasonic, Volumetric and Viscometric Studies of Molecular Interactions in Binary Liquid Mixtures of Hexadecane with 1-Pentanol, 1-Hexanol, and 1-Heptanol at (298, 308 and 318) K
04/2005 Characteristic Lattice Complexes
04/2005 Excellent Performance of La1−xCexSrNiO4 (x ≤ 0.3) for NO Decomposition in the Presence of Excess Oxygen
04/2005 The Extension of the Stability Range of the Reconstructed Au(111) Surface by Propanal
04/2005 Theoretical Study of the Electronically Excited States of B4, B4+ and B4−
04/2005 Viscosity of the System KF–K2NbF7–Nb2O5
04/2005 A Characteristic Effect of Pressure on the Inclusion Complexation of Modified β-Cyclodextrins with 4-Substituted Phenols
05/2005 STM3: a chemistry visualization platform
05/2005 Calculation of lattice energies of organic crystals: the PIXEL integration method in comparison with more traditional methods
05/2005 CPMD: Car-Parrinello molecular dynamics
05/2005 CRYSTAL: a computational tool for the ab initio study of the electronic properties of crystals
05/2005 The DL_POLY molecular dynamics package
05/2005 A brief introduction to the ABINIT software package
05/2005 GDIS: a visualization program for molecular and periodic systems
05/2005 Program LMTART for electronic structure calculations
05/2005 GULP: Capabilities and prospects
05/2005 Electronic structure and magnetic properties of solids
05/2005 Simulation of structural phase transitions by metadynamics
05/2005 First-principle studies of the lattice dynamics of crystals, and related properties
05/2005 Microscale characterization of uranium(VI) silicate solids and associated neptunium(V)
05/2005 First principles methods using CASTEP
05/2005 Radiochemical separation of actinides from environmental samples for determination with DF-ICP-MS and alpha spectrometry
05/2005 Diffusion and sorption of U(VI) in compacted bentonite studied by a capillary method
05/2005 Ab initio theory of planetary materials
05/2005 First-principles codes for computational crystallography in the Quantum-ESPRESSO package
05/2005 Chemical bonding in crystals: new directions
05/2005 Crystal structure of new uranyl oxalates (NH4)2[UO2(C2O4)2· H2O]·2H2O and (NH4)2-x(N2H5)x[(UO
05/2005 Extraction of U(VI) with unsymmetrical N-methyl-N-decylalkylamide in toluene
05/2005 A comparative evaluation of 238Pu determination in NIST-SRM-947-Pu by alpha spectrometry and thermal ionization mass spectrometry
05/2005 Speciation of Tc(IV) in chloride solutions by capillary electrophoresis
05/2005 On the transport and speciation of ruthenium in high temperature oxidising conditions
05/2005 Crystallography of selected high pressure elemental solids
05/2005 The effect of water treatment on the presence of particle-bound 210Po and 210Pb in groundwater
05/2005 First-principle study of materials involved in incommensurate transitions
05/2005 Advanced Laser Imaging Diagnostics in Combustion
05/2005 Carbon Dioxide Thermal Decomposition: Observation of Incubation
05/2005 Action Spectroscopy and Predissociation of Vibrationally Excited C2HD
05/2005 Combination of Laser- and Mass-Spectroscopic Techniques for the Investigation of Fuel-Rich Flames
05/2005 Rovibrational Energy Transfer in the 4νCH Manifold of Acetylene, Viewed by IR-UV Double Resonance Spectroscopy. 3. State-to-State J-Resolved Kinetics
05/2005 Conditional Velocity Measurements by Simultaneously Applied Laser Doppler Velocimetry and Planar Laser-Induced Fluorescence in a Swirling Natural Gas/Air Flame
05/2005 High-Growth-Rate Chemical Vapor Deposition of Silicon: an Experimental and Modeling Approach
05/2005 Monitoring Antibody Binding Events in Homogeneous Solution by Single-Molecule Fluorescence Spectroscopy
05/2005 NO Reburn and Formation Chemistry in Methane Diffusion Flames
05/2005 SACM/CT Study of Product Energy Distributions in the Dissociation of n-Propylbenzene Cations
05/2005 Classical Trajectory and Statistical Adiabatic Channel Study of the Dynamics of Capture and Unimolecular Bond Fission. VII. Thermal Capture and Specific Rate Constants k(E,J) for the Dissociation of Molecular Ions
06/2005 Solubility of uranium(IV) hydrous oxide in high pH solution under reducing condition
06/2005 Activation cross sections for reactions induced by 14 MeV neutrons on natural tin and enriched 112Sn targets with reference to 111In production via radioisotope generator 112Sn(n, 2n)111Sn&r
06/2005 Adsorption modeling and thermodynamic characteristics of uranium(VI) ions onto 1-(2-pyridylazo)-2-naphthol (PAN) supported polyurethane foam
06/2005 Sorption of trivalent plutonium onto UO2 and the effect of the solid phase on the Pu oxidation state
06/2005 Recovery of minor actinides from HLLW using the DIAMEX process
06/2005 Towards a DIAMEX process using high active concentrate. Production of genuine solutions
06/2005 The mobility of anthropogenic 129I in a shallow sand aquifer at Sturgeon Falls, Ontario, Canada
06/2005 Study on some physical chemistry aspects of extraction of uranium(VI) with bis(octylsulfinyl)methane
06/2005 Fluorescence Imaging of Reactive Processes
06/2005 Calculation of Gibbs Energy of Interaction (ΔG0int) of Neutral Benzoic Acids and their Anions
06/2005 Studies on Hydrophobic Interaction from the Conductometric Studies of Medicinal Compounds (as Salts)
06/2005 CO Oxidation over the Perovskite-Like Oxides La2−xSrxMO4 (x = 0.0, 0.5, 1.0; M = Cu, Ni): A Study from Cyclic Voltammetry
06/2005 Voltammetric and Spectroscopic Studies on the Interaction of Pentoxifylline with Cysteine in the Presence and Absence of UV Irradiation
06/2005 Arrhenius Relation and its Fractalization
06/2005 Argon Adsorption in Active Carbon at 77.3 K
06/2005 Kinetics and Mechanism of the Thermal Gas-Phase Reaction between NO2 and Trifluorobromoethene, CF2CFBr
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