50 results on '"Newsam, John M."'
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2. High Throughput Experimentation (HTE) Directed to the Discovery, Characterization and Evaluation of Materials
3. A theoretical study of the cluster vibrations in Cr2O2, Cr2O3, and Cr2O4
4. Mastering the Challenges of Catalyst Screening in High-Throughput Experimentation for Heterogeneously Catalyzed Gas-Phase Reactions
5. Hydrothermal synthesis and structure of a potassium tantalum defect pyrochlore
6. Framework crystal structure solution by simulated annealing: test application to known zeolite structures
7. Application of a novel Split&Pool-principle for the fully combinatorial synthesis of functional inorganic materials
8. Molecular simulations in heterogeneous catalysis
9. The importance of model behavior
10. High throughput experimentation for the synthesis of new crystalline microporous solids
11. Unique magnetic signature of transition metal atoms supported on benzene
12. High Throughput Experimentation (HTE) Directed to the Discovery, Characterization and Evaluation of Materials
13. ChemInform Abstract: Combinatorial Approaches as a Component of High-Throughput Experimentation (HTE) in Catalysis Research
14. ChemInform Abstract: High Throughput Experimentation for the Synthesis of New Crystalline Microporous Solids.
15. Screening soft materials for their effect on skin barrier function by high throughput experimentation
16. Parallel Synthesis and Testing of Catalysts for the Polymerization of Ethylene
17. Voraussage anorganischer Strukturen durch automatisierte Anordnung von Sekundärbausteinen (AASBU-Verfahren)
18. De Novo Prediction of Inorganic Structures Developed through Automated Assembly of Secondary Building Units (AASBU Method)
19. First Principles Study of Polyatomic Clusters of AlN, GaN, and InN. 1. Structure, Stability, Vibrations, and Ionization
20. Erratum
21. Modelling and simulation of solids
22. ChemInform Abstract: Molecular Simulations in Heterogeneous Catalysis
23. Combinatorial approaches as a component of high-throughput experimentation (HTE) in catalysis research
24. Density Functional Study of Chromium Oxide Clusters: Structures, Bonding, Vibrations, and Stability
25. Predicted Effects of Site-Specific Aluminum Substitution on the Framework Geometry and Unit Cell Dimensions of Zeolite ZSM-5 Materials
26. Role of density fluctuations in the solvation structure in supercritical dilute solutions: a molecular dynamics study
27. Molecular Dynamics Simulations of Metal Clusters and Metal Deposition on Metal Surfaces
28. Sorption capacities of three-dimensional crystalline microporous materials and defects
29. Density functional calculations on agostic ethyl-Ti (IV) complexes
30. Density functional study of structural and electronic properties of cube-like MgO clusters
31. Synthesis and Characterization of Octahedral Molecular Sieves (OMS-2) Having the Hollandite Structure
32. Behavior of benzene in siliceous faujasite: a comparative study of deuteron NMR and molecular dynamics
33. Neutron Powder Diffraction
34. The h = 0 term in Coulomb sums by the Ewald transformation
35. X-Ray crystallographic study of the preferred conformations of 2,6- and 3,5-dimethyl-1,4-dihydrobenzoic acids.
36. Novel β-lactams derived from the photoisomer of N-benzyloxycarbonylmethylene-2-pyridone.
37. De Novo Prediction of Inorganic Structures Developed through Automated Assembly of Secondary Building Units (AASBU Method) <FN ID="fnxx"> This work was supported by Centre National de la Recherche Scientifique. We thank F. J. J. Leusen, G. Engel, and A. K. Cheetham for useful assistance and discussions.</FN>
38. Conformational studies of dihydrotetraphenylmethanes. I. X-ray crystallographic and solution hydrogen-1 NMR studies of trans-1,4-dihydro-4-tritylbiphenyl and its 4'-bromo derivatives: boat-boat inversion in a congested cyclohexa-1,4-diene
39. Syntheses and molecular and electronic structures of the .mu.4-methylidyne clusters [Fe4(CO)12C.cntdot.C(O)OCH3]- and [Fe4(CO)12C.cntdot.C(O)CH3]-: an analysis of steric and bonding effects
40. Steric effects in iron butterfly clusters, Fe4(CO)12CR, probed by interactive molecular graphics
41. Slow Neutron Polarization by Longitudinally Polarized Proton Filter
42. Anhydrous deuterium β-alumina: Powder neutron diffraction studies at 4.2, 298, 573, and 720 K
43. Mastering the Challenges of Catalyst Screening in High-Throughput Experimentation for Heterogeneously Catalyzed Gas-Phase Reactions.
44. ChemInform Abstract: High Throughput Experimentation for the Synthesis of New Crystalline Microporous Solids.
45. ChemInform Abstract: Combinatorial Approaches as a Component of High-Throughput Experimentation (HTE) in Catalysis Research.
46. The solid solutions Na 3(1−x)Al x▭ 2xPO 4: room temperature powder neutron diffraction studies of the two compositions x=0.025 and x=0.2
47. Structural studies of the high-temperature modifications of sodium and silver orthophosphates, II-Na 3PO 4 and II-Ag 3PO 4, and of the low-temperature form I-Ag 3PO 4
48. Thermal evolution of the structure of ammonium β-alumina
49. Some comments on “relation entre structure et conductivite ionique basse temperature Ag 3PO 4”
50. The crystal structure of a new sodium zinc arsenate phase solved by “simulated annealing”
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