Tag: density functional theory
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Pages: 55 |
Price: ₦5000 |
Chapters: 1-5
CALCULATIONS OF PHONONS AND PHONON DISPERSION IN LIFEP PNICTIDE SUPERCONDUCTOR Abstract: LiFeP is a pnictide superconductor that has attracted significant attention due to its potential for high-temperature superconductivity and …
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Pages: 60 |
Price: ₦5000 |
Chapters: 1-5
MODELLING OF CONTACT AND ADHESION AT INTERFACES IN BULK HETEROJUNCTION SOLAR CELLS Abstract: Bulk heterojunction solar cells (BHJSCs) have gained considerable attention due to their potential for efficient and …
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Pages: 55 |
Price: ₦5000 |
Chapters: 1-5
DEVELOPMENT OF A CORRECTION TERM FOR THE KINETIC ENERGY DENSITY FUNCTIONAL Abstract: The kinetic energy density functional (KEDF) is a fundamental concept in density functional theory (DFT), a widely …
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Pages: 60 |
Price: ₦5000 |
Chapters: 1-5
AB INITIO DENSITY STUDY OF N AND O COADSORPTION ON PT(100) AND PT(111) Abstract: The coadsorption of nitrogen (N) and oxygen (O) on platinum (Pt) surfaces plays a crucial …
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Pages: 60 |
Price: ₦5000 |
Chapters: 1-5
ABSORPTION OF MOLECULAR HYDROGEN SULPHIDE ON GOLD CLUSTERS Abstract: The absorption of molecular hydrogen sulphide (H2S) on gold clusters has garnered significant attention due to their potential applications in …
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Pages: 60 |
Price: ₦5000 |
Chapters: 1-5
STRUCTURAL, ELECTRONIC AND OPTICAL PROPERTIES OF CU 2 SNS 3 SOLAR ABSORBER: A FIRST-PRINCIPLE DENSITY FUNCTIONAL THEORY INVESTIGATION Abstract: Cu2SnS3 (CTS) has emerged as a promising candidate for thin-film …
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Pages: 55 |
Price: ₦5000 |
Chapters: 1-5
GRAPHENE-HEXAGONAL BORON NITRIDE WORK FUNCTION RESPONSE TO UNIFORM PLANAR DEFORMATIONS: AN AB INITIO DFT STUDY Abstract: Graphene and hexagonal boron nitride (hBN) are two-dimensional materials with unique electronic properties …
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Pages: 50 |
Price: ₦5000 |
Chapters: 1-5
STRUCTURAL AND ELECTRONIC PROPERTIES OF A TWO-DIMENSIONAL HYBRID SYSTEM OF GRAPHENE AND HEXAGONAL BORON NITRIDE: A FIRST-PRINCIPLES STUDY Abstract: Two-dimensional (2D) materials have attracted significant attention due to their …
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Pages: 55 |
Price: ₦5000 |
Chapters: 1-5
SUBSTITUTIONAL AND VACANCY DEFECTS IN TWO-DIMENSIONAL ALSB: A FIRST PRINCIPLE APPROACH Abstract: Two-dimensional (2D) materials have garnered significant interest due to their unique electronic, optical, and mechanical properties. In …
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Pages: 55 |
Price: ₦5000 |
Chapters: 1-5
FIRST PRINCIPLES STUDY OF POROUS CARBON AS ANODE MATERIAL FOR METAL-ION (NA, LI, MG) BATTERIES APPLICATIONS Abstract: Metal-ion batteries have gained significant attention as a promising alternative to conventional …
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Pages: 55 |
Price: ₦5000 |
Chapters: 1-5
FIRST-PRINCIPLES DENSITY FUNCTIONAL THEORY STUDIES OF THE STRUCTURAL AND ELECTRONIC PROPERTIES OF PRODIGIOSIN AS A CANCER DRUG Abstract: Prodigiosin is a natural red pigment produced by various bacterial species …
