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Chemistry of Materials
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139
Chemistry
Undergraduate 1
04/08/2014

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Term
What are A and X in zAX
Definition

A: Mass number, number of electrons and neutrons

B: Atomic Number, number of protons

number of electrons is usually equal to protons

Term
Maximum number of electrons per orbital
Definition
2
Term
Order of Shells
Definition
1s 2s 2p 3s 3p 4s 3d 4p
Term
Define Ionisation Energy
Definition
The minimum energy required (to be added to the atom) to remove the outermost electron from the ground state of an isolated (eg. gaseous) atom
Term
In what directions Ionisation Energy increases/decreases
Definition
Decreases from top to bottom
Increases from left to right
Term
Three properties of ionisation energy
Definition
-Increases as successive electrons are removed
-Sharp increase when an inner-shell electron is removed
-High values of IE are why only valence electrons are involved in bonding
Term
Define Electron Affinity
Definition
The energy change that occurs when an electron is added to a gaseous atom - measures attraction of atom for the added electron
Term
Properties of Electron Affinity
Definition
-Typically, energy is released when an electron is added (negative value)
-Typically increases (more negative) left to right
-Noble gasses are positive
-typically is positive (energy gained) when the added electron begins a new shell (eg. noble gasses, Be, Mg)
Term
Define Electronegativity
Definition
The ability of an atom in a molecule to attract electrons to itself
Term
In what directions Electronegativity increases/decreases
Definition
Increase from left to right
Decrease from top down
Term
Describe Hydrogen Bonding
Definition
when the molecules in a molecular compound have both a hydrogen atom and at least one "lone pair" of electrons, the hydrogen of a molecule will be strongly attracted to the lone pair on an adjacent molecule, creating above average inter-molecular force.
http://chemwiki.ucdavis.edu/Physical_Chemistry/Quantum_Mechanics/Atomic_Theory/Intermolecular_Forces/Hydrogen_Bonding
Term
Formal Charge formula
Definition

F = V - (N + B/2)

V = Valence Electrons

N = Non-Bonding Electrons

B = Bonding Electrons

Term
applying formal charge
Definition
Term
The four types of solids
Definition
Molecular
Covalent Network
Ionic
Metallic
Term
Properties of Molecular Solids
Definition
-Intermolecular forces are weak
-Thus low melting point
-Room temperature gases and liquids usually form molecular solids at low temperature
Term
Crystalline solid:
Definition
well-ordered, definite arrangements of molecules, atoms or ions. Crystals have an ordered, repeated structure
Term
Amorphous solid:
Definition
no ordered structure,
e.g. rubber, glass
Term
Properties of Covalent Network Solids
Definition
-Atoms held together in large networks by covalent bonds
-Examples: diamond, graphite, quartz (SiO2), silicon carbide (SiC), and boron nitride (BN)
Term
About Carbon Nanotubes
Definition
-Example of covalent network
-Long cylindrical structures
-Either single or multi walled
-Potential structural applications in high strength materials
-Applications in a range of conductive materials
Term
Properties of Ionic Solids
Definition
-Regular structures, packing of positive and negative ions around each other
-Hard, brittle, high melting points
-Poor electrical conductors
Term
Properties of Metallic Solids/Bonding
Definition
-Metal ions in a sea of delocalised valence electrons --> good electrical conductor
-Strong bonding
-Without any definite directions for bonds, the metals are easy to deform
Term
coordination number of simple cubic, body-centred cubic and fcc
Definition
6, 8, 12
Term
occupation of simple cubic, body-centred cubic and fcc
Definition
52%, 68%, 74%
Term
Example of simple cubic
Definition
α-Po
Term
Examples of body-centred cubic
Definition
Ba, Cr, Fe, W, alkali metals
Term
examples of fcc
Definition
For example: Ag, Al, Au, Ca, Cu, Ni, Pb, Pt
Term
Images of cubic unit cells
Definition
[image]
Term
For CCP, the stacking pattern that produces hexagonal close packing
Definition
ABABABAB,
rather than ABCABCABCABC for Cubic Close Packing
Term
picture of hexagonal close packing
Definition
[image]
Term
The two packing types for FCC
Definition
Hexagonal close packing
Cubic close packing
Term
Differences between Hexagonal close packing and Cubic close packing
Definition
Cubic: Ductile
Hexagonal: Brittle
Term
Properties of Metals vs Non-Metals
Definition
Metals:
-Low ionisation energy rather than High
-Malleable rather than usually brittle
-Good electrical conductors
Term
about heterogeneous alloys
Definition
components not dispersed uniformly
Term
Two types of Solution alloys
Definition
-Substitutional alloys - solute atoms disperse main atoms
-Interstitial alloys - solute atoms occupy empty space between main atoms
Term
about Substitutional alloys
Definition
-All atoms radius within 15% of each other
-Elements must have similar bonding characteristics
-Elements Must have same crystal structure
-Elements Must have Similar Electronegativity
Term
about Interstitial alloys
Definition
-One element must have a significantly smaller radius than the other
Term
describe triple point
Definition
P and T at which all three phases
are in equilibrium
Term
what is abnormal about water phase diagram
Definition
the solid-liquid line goes backward (i.e. solid is less dense than liquid)
Term
what is a supercritical fluid
Definition
a fluid that is beyond the temperature and pressure of the critical point. has a density of liquid and viscosity of gas.
Term

explain the steps:

[image]

Definition
Energy is released by the changing of bonds as the iron changes phase, and so the material does not overall cool down at during these phase changes.
Term
how to read binary phase diagram (picture)
Definition
[image]
Term
what is silica
Definition
Silicon Dioxide
Term
what is Carbonate
Definition
(CO3)2-
Term
what is Silicate
Definition
(SiO4)4-, tetrahedra
Term
basic steps for making portland cement
Definition
[image]
Term
About setting cement
Definition
-Reaction of clinker materials with water to give gelatinous calcium silicates, solid Ca(OH)2, complex silicates, calcium aluminates, etc
-In concrete, the hydrated materials bind to solid aggregates (stones)
-Hydration reaction of Portland cement results in hardening
-There are rapid reactions within hours, and slow reactions over years
Term
a few examples of things made from petroleum/crude oil
Definition
-liquid Fuels
-plastics
-detergents
-soaps
-drugs
Term
picture of crude oil reservoir
Definition
[image]
Term
Elements/percentages in petroleum
Definition
-Carbon 84%
-Hydrogen 14%
-Sulfur 1-3%
-Nitrogen, oxygen, metals, salts <1% each
Term
Hydrocarbons in petroleum
Definition
-Alkanes ~30%
-Cycloalkanes ~50%
-Aromatics ~15%
Term
General formula of alkanes
Definition
CnH(2n+2)
Term
the three basic steps of crude oil before final use
Definition
-Washing/desulfurisation: REMOVAL OF SALTS AND MINERAL CONTAMINANTS
-Seperation: Fractional Distillation
-Conversion: Reforming, Cracking, Alkylation and Isomerisation
Term
Details of fractional distillation
Definition
Crude oil is heated to ~600C and blasted into a distillation tower. The fuels come out in broad fractions based on number of carbons
Term
Basics of the four conversion processes
Definition
-Reforming: changes alkanes and cycloalkanes to more valuable aromatics (reformer)
-Cracking(Pyrolysis): breaks large hydrocarbons to smaller ones (coker)
-Alkylation: Changes alkanes and alkenes to larger branched alkanes (alkylation unit)
-Isomerisation: Alters arrangement of atoms in molecule
Term
details of Reforming
Definition

-Uses heat, pressure and a catalyst

[image]

Term
schematic of reforming unit
Definition
[image]
Term
three types of cracking
Definition

Catalytic cracking

Hydrocracking

Steam/Thermal cracking

Term
about catalytic cracking
Definition

-Catalysts help reactions

-Typically ~900C and 10-20psi

-Three basic functions:

--Reaction of catalyst and feedstock cracks feedstock into    different hydrocarbons

--catalyst is reactivated by burning off coke

--new hydrocarbons are distilled into different weights

Term
Example chemical reaction of catalytic cracking
Definition
C15H32 --> 2C2H4 + C3H6 + C8H18
Term
about fluid catalytic cracking
Definition
-Feedstock is vaporised and mixed with a fluidised powdered catalyst (very very fine behaves like liquid)
-Carbon is deposited ON the catalyst, requiring it to be "regenerated" occasionally
-Modern implementations use a continuous loop system so the process can run while catalyst is regenerated
Term
schematic of fluidised-bed cracking plant
Definition
[image]
Term
about hydrocracking
Definition
-Uses elevated partial pressure of hydrogen gas and catalysts
-Pressure of 1000-2000 Psi
-Temperature of 400-800 C
-Produces only saturated products
Term
about thermal/steam cracking
Definition
-Hydrocarbon diluted with steam and briefly heated in furnace without O2
-850°C, slightly above atmospheric pressure
-Residence time very short in reactor # milliseconds
Term
about alkylation
Definition
-Uses strong acid catalyst (sulfuric or hydrofluoric acid) and temperatures 0-30C
-High ratio of alkane to alkene
-Upgrades low molecular weight alkanes and alkenes to branched alkanes with increased molecular weight
Term
Example equation of alkylation
Definition
[image]
Term
details of isomerisation
Definition
-rearrangement of straight chain alkanes to branched alkanes
-Uses hydrogen, chloride and catalyst
-creates extra alkane feed for alkylation
-improves the octane of straight run alkanes
Term
example euqation of isomerisation
Definition
[image]
Term
Define Fuel
Definition
Fuel is any material that is burned or altered to obtain energy to do work through a chemical reaction.
Term
Fuel Classification
Definition
6 classes: class 1(light) to 6(heavy)
light/heavy as in length of carbon change and increase in boiling point and viscosity
Term
about virgin/straight-run gasoline
Definition
not suitable for modern engines, but is the main part of the fuel blend
Term
the four stroke gasoline cycle (image)
Definition
Term
define is compression ratio
Definition
is equal to V/v,
V = Volume of cylinder at the bottom of the cyle
v = volume of the cylinder at the top of the cycle
Term
about compression ratio
Definition
-Increases efficiency, somewhat logarithmically
-Modern cars R = ~9:1
-High compression ratio means fuel/air can spontaneously ignite --> knocking
-knocking prevented by high octane fuel
Term
about octane number
Definition
-ON measures a fuel's resistance to auto-ignition
-modern cars require ON>~90
Term
what is octane rating of straight-run gasoline
Definition
~60
Term
how Octane Number is measured
Definition
-Measured in a test engine
-iso-octane has the benchmark ON of 100
-n-heptane (plain C7H16) has ON of 0
e.g. gasoline with the same knocking characteristics as a mixture of 90% iso-octane and 10% heptane would have an octane rating of 90
Term
how octane ratingincreases for different hydrocarbans
Definition
Term
tyeps of fuel additives
Definition
Anti-knock
Lead replacement
antioxidants
de-icers
rust inhibitors
Term
about anti-knock additives
Definition
-lead is a cheap anti-knock additive, but obvious health dangers AND incompatibility with catalytic converters
-lead replaced by hydrocarbons of higher octane rating
Term
about antioxidant additives
Definition
-often amines
-prevent build up of gum, which can lead to engine damage and performance decrease
Term
about cetane number
Definition
-opposite of octane number
-measures ease at which fuel will undergo compression ignition
-for typical use CN = ~50
Term
approximate carbon chain length of gasoline
Definition
4-12
Term
approximate carbon chain length of diesel
Definition
8-21
Term
what is biodiesel primarily made of
Definition
triglycerides - triesters of glycerol with 3 long chain fatty acids
Term
reaction for production of biodeisel
Definition
TRANSESTERIFICATION
triglyceride + Methanol --> Biodiesel + Glycerin
Term
advantages/disadvantages of biodiesel
Definition
-Works in most diesel engines, Sustainable, less pollutants than fossil fuel, safer to handle than fossil fuels
-Can be problematic in some engines, lower fuel economy than fossil fuel
Term
blending of biodiesel
Definition
Can be used pure of blended with petroleum
"B-factor":
100% biodiesel is referred to as B100;
20% biodiesel = B20
Term
What is an explosive
Definition
Substance containing a tremendousamount of poten0al energy stored in chemical bonds.
Term
what makes an explosion
Definition
rapid release/expansion of gasses -> pressure
production of heat
quick release of energy
produces more stable substances (mainly gasses)
Term
difference between fuels and explosives
Definition
Fuels react in a controlled manner
explosives react rapidly and violently
Term
define high explosive. examples
Definition
speed of reaction is faster than the speed of sound
Dynamite, TNT, plastic explosives
Term
define low explosive. example
Definition
speed of reaction slower than speed of sound
Black Powder
Term
Two useful specification tests for explosives, units
Definition
Explosive Strength (cal/qty)
velocity of Detonation (m/s)
Term
Trauzl test - brief description
Definition
10g of explosive is placed in a cavity in a lead block, covered with sand and then detonated.
Resulting volume of cavity is compared to the Standard Volume produced by gelignite
Term
basic methods of determining velocity of detonation
Definition
optical or electrical
Term
an explosive may consist of either:
Definition
a chemically pure compound
a mixutre of fuel and oxidzer
Term
common oxidizers
Definition
ammonium"nitrate,"sodium"nitrate,"calcium"nitrate
Term
two necessary structural features of molecular explosives
Definition
at least on chemical bond that can easily be broken
A high proportion of oxygen required for explosion within the molecule itself
Term
examples of weak bonds for molecular explosives
Definition
N-O
N-N
N-Cl
O-Cl
Term
about oxygen balance
Definition
indicates degree to which an explosive can be oxidised
-Zero: exactly enough oxygen
-Positive: more than enough oxygen
-Negative: Not enough oxygen
Maximum explosiveness as oxygen balance approaches zero
Term
how to tell if reaction has positive or negative oxygen balance
Definition
Pos: O2 produced
Neg: C or CO produced
Term
about primary explosives. Example
Definition
-Very powerful
-Very sensitive
-Usually used as only a detonator
-Mercury Fulminate
Term
About Secondary Explosives. Example
Definition
-aka high explosives
-Most explosives are secondary explosives
-nitroglycerin
-PETN - Benchmark. More explosive than PETN in primary explosive
-RDX
-Semtex
Term
About tertiary explosives. Example
Definition
-Not explosive unless mixed with other combustibles.
-Inexpensive
-must be detonated by secondary explosives
-ANFO (Ammonium Nitrate + Fuel Oils)
Term
Use of explosive mixture allows control of
Definition
-Strength
-V.O.D.
-Cost
-Safety
Term
what is a polymer
Definition
made up of many repeating monomers.
High molecular weight
Term
Polymerisation
Definition
the process of linking monomers
Term
advantages of polymers
Definition
-Ease of processing
-Light Weight
-Tough
-Low Friction
-Flame retardant
-Insulating
-Appearance
-Weather/chemical resistance
Term
how increasing polymer chain length affects physical properties
Definition
as chain length increases:
-melting and boiling point increase
-impact resistance increases
-viscosity increases
-chain mobility decreases
-strength and toughness increase
Term
how polymer branching affects physical properties
Definition
can be linear, branched, cross-linked
affects chain packing and polymer density
Term
how interchain interactions affects physical properties
Definition
-Interaction of chains through hydrogen bonding etc,
-rotation of carbon bonds
-affects strength and rigidity
Term
about polymer non-uniform/disordered packing
Definition
-amorphous
-less rigid - malleable
-weaker
Term
about polymer crystalline packing
Definition
- crystalline-like
-increased regidity, strength and opactity
-more brittle
Term
about vulcanisation
Definition
vulcanisation: to natrual rubber heat and add sulfur. sulfur cross-links to make more rigid. 30% cross-linking is very rigid rubber.
Term
Glass transition temperature
Definition
the temperature at which the transitionin the amorphous regions between glassy and rubbery occurs
Term
How chain mobility affects Tg
Definition
more immobile chain --> higher Tg
Term
How chain length affects Tg
Definition
Tg increases with increasing chain length
Term
about plasticisers
Definition
-can be added to a polymer
-increase rubberyness of polymer
-decreaes Tg
Term
atactic side chains
Definition
side chains are randomly distributed
Term
isotactic side chains
Definition
side chains are all on the same side
Term
syndiotactic side chains
Definition
side chains are on alternating sides
Term
five factors affecting Tg:
Definition
-stiffer chain groups raise Tg
-strong intermolecular forces raise Tg
-side group restrict rotation, raise Tg
-cross linking raises Tg
-plasticisers lower Tg
Term
how to identify addition polymer
Definition
the repeating unit is always the same as the monomer from which the polymer is made
Term
The four addition polymerisation procedures
Definition
-Radical Polymerisation
-Cationic Polymerisation
-Anionic Polymerisation
-Coordination Polymerisation
Term
General characteristics of radical addition polymerisation
Definition
-Polymer chains form rapidly
-Extremely Exothermic
-Branching and cross-linking is common
Term
what is copolymer
Definition
polymer with more than one repeating monomer
Term
statistical copolymer
Definition
different monomers are distributed randomly
Term
alternating copolymer
Definition
different monomers are alternating
ABABABABABABAB
Term
block copolymers
Definition
different monomers occur in blocks
AAAAAABBBBBBBAAAAAAAAAAAAAAABBBBBAAA
Term
graft copolymers
Definition
one monomer is main chain, another is a side chain
Term
about ABS
Definition
-very tough and strong
Term
about SBR Styrene Butadine Rubber
Definition
-tyres, chewing gum
-replacement for natural rubber
Term
applications of polyamides
Definition
-heat resistant
-strong synthetic fibres
-aerospace
-military
-kevlar
Term
about epoxy-resins
Definition
-strongest known adhesives
-chemical and heat resistant
Term
about dental polymers
Definition
slowly begin to cross-link, so time to shape around teeth
Term
about thermoplastic polymers
Definition
-can be heated to softening without degradation
-not cross-linked
-difunctional monomers
Term
about thermosetting polymers
Definition
-very hard and rigid once formed
-degrade when melted
-highly cross-linked
Term
examples of thermoplastics
Definition
Nylon, polystyrene
Term
about bioplastics
Definition
-made from renewable biomass
can degrade...
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