LOBSTER: A tool to extract chemical bonding from plane-wave based DFTThe Crystal Structure of Mn2O7Systematic study on the electronic structure and mechanical properties of X2BC (X = Mo, Ti, V, Zr, Nb, Hf, Ta and W).A Rietveld refinement method for angular- and wavelength-dispersive neutron time-of-flight powder diffraction data.Instrumental resolution as a function of scattering angle and wavelength as exemplified for the POWGEN instrument.Solid-state structure of free base guanidine achieved at last.High-Pressure NiAs-Type Modification of FeN.Lattice thermal expansion and anisotropic displacements in urea, bromomalonic aldehyde, pentachloropyridine, and naphthalene.Molybdenum Oxide Nitrides of the Mo2(O,N,□)5 Type: On the Way to Mo2O5.Atomic motions in the layered copper pseudochalcogenide CuNCN indicative of a quantum spin-liquid scenario.Synthesis, Crystal Structure, Magnetic Properties, and Stability of the Manganese-Rich "Mn3AlC" κ Phase.Lattice thermal expansion and anisotropic displacements in 𝜶-sulfur from diffraction experiments and first-principles theory.Ab initio thermochemistry of solid-state materials.Transition-Metal Carbodiimides as Molecular Negative Electrode Materials for Lithium- and Sodium-Ion Batteries with Excellent Cycling Properties.Thermodynamic Properties of Molecular Crystals Calculated within the Quasi-Harmonic Approximation.Ab initio lattice dynamics and thermochemistry of layered bismuth telluride (Bi2Te3).Monoclinic polymorph of poly[[di-μ-aqua-triaquadi-μ-oxalato-barium(II)-copper(II)] monohydrate].Tris(oxamide dioxime-κN,N')nickel(II) sulfate penta-hydrateEffective Hamiltonian Crystal Field as applied to magnetic exchange parameters in μ-oxo-bridged Cr(III) dimers.A ferromagnetic carbodiimide: Cr2(NCN)3.Modeling molecular crystals formed by spin-active metal complexes by atom-atom potentials.RbCN3H4: the first structurally characterized salt of a new class of guanidinate compounds.Analytic projection from plane-wave and PAW wavefunctions and application to chemical-bonding analysis in solids.Bis(cyanoguanidine)silver(I) nitrate-cyanoguanidine (1/1).Experimental and quantum-chemical studies on the thermochemical stabilities of mercury carbodiimide and mercury cyanamide.Synthesis, characterization, and quantum-chemical studies of Ni(CN)2MX (M = Rb, Cs; X = Cl, Br).The amount of calcium-deficient hexagonal hydroxyapatite in aortic valves is influenced by gender and associated with genetic polymorphisms in patients with severe calcific aortic stenosis.Hydrogen bonding in the crystal structures of the ionic liquid compounds butyldimethylimidazolium hydrogen sulfate, chloride, and chloroferrate(II,III).LiSr2(NCN)I3: the first empty tetrahedral strontium(II) entity coordinated by carbodiimide units but without strontium-strontium bonding.High-resolution neutron diffraction study of CuNCN: new evidence of structure anomalies at low temperature.High-pressure synthesis and characterization of Li2Ca3[N2]3--an uncommon metallic diazenide with [N2]2- ions.FeNCN and Fe(NCNH)2: synthesis, structure, and magnetic properties of a nitrogen-based pseudo-oxide and -hydroxide of divalent iron.Synthesis, crystal structure, and properties of MnNCN, the first carbodiimide of a magnetic transition metal.A theoretical study on the structures and energetics of hypothetical TiM(NCN)3 compounds of the 3d transition metals.Eu8(NCN)5-deltaI6+2delta (delta= 0.05): a novel rare-earth carbodiimide iodide containing oligomeric tritetrahedral Eu8 clusters.Electron group functions for the analysis of the electronic structures of molecules.[Co(I)(CN)2(CO)3]-, a new discovery from an 80-year-old reaction.HP-MoO2: A High-Pressure Polymorph of Molybdenum Dioxide.The Orbital Origins of Magnetism: From Atoms to Molecules to Ferromagnetic Alloys.First-Principles Chemical Bonding Study of Manganese Carbodiimide, MnNCN, As Compared to Manganese Oxide, MnO.
P50
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P50
description
Duits scheikundige
@nl
German chemist and physicist
@en
chimiste allemand
@fr
deutscher Chemiker und Physiker
@de
tysk fysikar og kjemikar
@nn
tysk fysiker och kemist
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tysk fysiker og kemiker
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tysk fysiker og kjemiker
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شیمیدان و فیزیکدان آلمانی
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كيميائي ألماني
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Richard Dronskowski
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Richard Dronskowski
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Richard Dronskowski
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Richard Dronskowski
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Richard Dronskowski
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Richard Dronskowski
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Richard Dronskowski
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Richard Dronskowski
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Richard Dronskowski
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Richard Dronskowski
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type
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Richard Dronskowski
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Richard Dronskowski
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Richard Dronskowski
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Richard Dronskowski
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Richard Dronskowski
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Richard Dronskowski
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Richard Dronskowski
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Richard Dronskowski
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Richard Dronskowski
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Richard Dronskowski
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Richard Dronskowski
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Richard Dronskowski
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Richard Dronskowski
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Richard Dronskowski
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Richard Dronskowski
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Richard Dronskowski
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Richard Dronskowski
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Richard Dronskowski
@nb
Richard Dronskowski
@nds
Richard Dronskowski
@nl
P106
P1006
P214
P227
P244
P269
P1006
P1412
P1559
Richard Dronskowski
@de
P19
P2038
Richard_Dronskowski
P21
P213
0000 0001 1689 9549
P214
P227
P2381
P244
no2006056740
P269
P31
P496
0000-0002-1925-9624
P569
1961-11-11T00:00:00Z