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1 1 • Crystallinity – Unit Cell – Crystallographic Points, Directions, and Planes. • Noncrystallinity (Amorphous) STRUCTURES OF METALS Issues To Address…. 2 • atoms pack in periodic, 3D arrays Crystalline materials... -metals -many ceramics -some polymers • atoms have no periodic packing Noncrystalline materials... -complex structures -rapid cooling crystalline SiO2 noncrystalline SiO2"Amorphous" = Noncrystalline Materials and Packing Si Oxygen • typical of: • occurs for: 3 • Non dense, random packing • Dense, regular packing Dense, regular-packed structures tend to have lower energy. Energy r typical neighbor bond length typical neighbor bond energy Energy r typical neighbor bond length typical neighbor bond energy Energy And Packing 4 • tend to be densely packed. • have several reasons for dense packing: -Typically, only one element is present, so all atomic radii are the same. -Metallic bonding is not directional. -Nearest neighbor distances tend to be small in order to lower bond energy. • have the simplest crystal structures. Metallic Crystals • Unit Cell is the basic structural unit of crystal structure. It is generally defined in terms of atom (ion) positions within a parallepiped volume. 5 Unit Cell • The atomic order of the crystalline solids is represented by the cell • Various structural units that describe the crystalline structure • The simplest Structural Unit is the unit cell 6 • Rare due to poor packing (only Po has this structure) • Close-packed directions are cube edges. • Coordination # = 6 (# nearest neighbors) Simple Cubic Structure (SC) contains 8 x 1/8 = 1 atom/unit cell close-packed directions a R=0.5a 2 7 • Coordination # = 12 • Close packed directions are face diagonals. --Note: All atoms are identical; the face-centered atoms are shaded differently only for ease of viewing. Face Centered Cubic Structure (FCC) Unit cell contains: 6 x 1/2 + 8 x 1/8 = 4 atoms/unit cell 8 • Coordination # = 8 • Atoms touch each other along cube diagonals. --Note: All atoms are identical; the center atom is shaded differently only for ease of viewing. Body Centered Cubic Structure (BCC) ex: Cr, W, Fe (α), Tantalum, Molybdenum 2 atoms/unit cell: 1 center + 8 corners x 1/8 9 • Coordination # = 12 • ABAB... Stacking Sequence • 3D Projection • 2D Projection Hexagonal Close-Packed Structure (HCP) 6 atoms/unit cell ex: Cd, Mg, Ti, Zn c a A sites B sites A sites Bottom layer Middle layer Top layer 10 Crystallographic directions • Can determine atom positions in unit cell • Certain direction in unit cell are important with respect to deformation in metals • Metals deform in directions along which atoms are in closet contact • Miller indices are used to describe these directions 11 Point Coordinates (position) Point coordinates for unit cell center are a/2, b/2, c/2 ½ ½ ½ Point coordinates for unit cell corner are 111 z x y a b c 000 111 12 Directions • [uvw] • Directions are vectors • Neg. directions are possible • Fractions may also be used • [111] y x z 3 13 Crystallographic Directions z x y - a3 a1 a2 z - a3 a1 a2 z 14 Crystallographic Planes z x y a b c 2. Miller Indices (110) example a b c z x y a b c 2. Miller Indices (100) 1. Intercepts 1 1 ∞ 1. Intercepts 1/2 ∞ ∞ example a b c 15 Crystallographic Planes (HCP) • In hexagonal unit cells the same idea is used example a1 a2 a3 c 2. Miller-Bravais Indices (1011) 1. Intercepts 1 ∞ -1 1 a2 a3 a1 z 16 • Most engineering materials are polycrystals. • Each "grain" is a single crystal. • If grains are randomly oriented, overall component properties are not directional. • Grain sizes typ. range from 1 nm to 2 cm (i.e., from a few to millions of atomic layers). 1 mm Polycrystals Isotropic Anisotropic 17 • Single Crystals -Properties vary with direction: anisotropic. -Example: the modulus of elasticity (E) in BCC iron: • Polycrystals -Properties may/may not vary with direction. -If grains are randomly oriented: isotropic. (Epoly iron = 210 GPa) -If grains are textured, anisotropic. 200 μm Single vs Polycrystals E (diagonal) = 273 GPa E (edge) = 125 GPa 18 Polymorphism • Two or more distinct crystal structures for the same material (allotropy/polymorphism) titanium α, β-Ti carbon diamond, graphite BCC FCC BCC 1538ºC 1394ºC 912ºC δ-Fe γ-Fe α-Fe liquid iron system
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