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Keyword [Computations]
Result: 21 - 40 | Page: 2 of 3
21. Theoretical Investigations On The New And Nonprecious HER Catalysts Based On The Layered SnP3 Nanosystems And The Correlative Catalytic Mechanisms
22. Design And Simulation Of Novel Two-dimensional Energy Storage Materials Based On Density Functional Theory Calculations
23. Some advances in the polyhedral model
24. Dynamical methods for rapid computations of L-functions
25. Performance analysis and middleware assisted adaptation for quantum chemistry computations
26. Molecular design for nonlinear optical materials and molecular interferometers using quantum chemical computations
27. Solid sweeping: Properties, computations and applications
28. Properties of nanoscale dielectrics from first principles computations
29. Reliable asymmetric phase stability computations using interval analysis
30. Scaling up Scientific Computations by using Map-Reduce-like Control Flow on NUMA Architectures
31. Investigations of noncovalent interactions using Raman spectroscopy and electronic structure computations
32. Fundamental Properties of Biologically Relevant Radicals Studied by Neutralization-Reionization Mass Spectrometry and Computations
33. Computational aeroelasticity using a pressure-based solver
34. FEA Simulation on Dielectric Composite and Semi-Crystalline Composite, and Analytical Computations and Approximations for the Charge, Force and Chemical Potential for a Prolate Spheroid Aligned with an Electric Field
35. Principles of chemical reactivity on the Diels-Alder reaction in ionic liquids and Lewis acid catalysis using large-scale computations
36. Molecular computations on selectivity and permeation in ion channels and transporters
37. Phase field computations and comparison with experiments
38. Numerical simulation of transport processes in multiphase systems
39. Sampling the potential energy surface of a DNA duplex damaged by a food carcinogen: Force field parameterization by ab initio quantum calculations and conformational searching using molecular mechanics computations
40. Computations and interpretations: The growth of quantum chemistry, 1927-1967
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