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Keyword [Density Functional Theory]
Result: 41 - 60 | Page: 3 of 10
41. Nano Preparation Of Amorphous Carbon Films And Their Field Electron Emission Properties
42. Theoretical Study Of Nmr Coupling System
43. Lead Tungstate Crystal Electronic Structure And Optical Properties Of The Study
44. First-principles Study Of The Quantum Transport Properties Of Molecular Devices
45. Conjugated Organic Oligomers Second-order Stark Effect And The Ground State Of Quantum Transport
46. First-principles Study Of Electronic Transport Properties Of Organic Molecular Devices
47. Study Of SmFeAsO1-xFx Defect By Positron Annihilation Techniques
48. First-principle Theory Study On Optimization And Mechanism Of Filled Skutterudites
49. Theoretical Investigation On The Structures And Properties Of Pd2Sin And Hfn Clusters As Well As L-ascorbic Acid And Their Derivatives
50. Global Optimization Of Cluster Structures Based On Genetic Algorithm
51. Study On The Geometrical Structures, Interactions And Photophysical Properties Of Four Hydrogen Bond Clusters
52. Study Of Electronic Structures And Related Properties Of Several Photocatalytic Semiconductors From First-principles Calculations
53. Theoretical Investigation On The Transport Properties Of Environment-friendly Thermoelectric Silicides
54. Theoretical Study Of Ti-zr-based Cluster Structure And Physical Chemical Properties
55. The Studies On The Two-Photon Absorption Of Push-Pull π-Conjugated Molecules
56. Density Functional Theory Study On Iron Clusters
57. Theoretical Study Of Polarizability And Hyperpolarizability Of Molecule And Cluster
58. The Effective Interaction Between Charged Colloids
59. Study Of Isothermal Equation Of State Of Aluminium
60. Theoretical Investigation On Geometrical And Electronic Structure Of The RhSi_n(n=1-6) Clusters
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