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Mathematical models can take many forms, including
dynamical systems,
statistical models,
differential equations, or
game theoretic models.
These and other types of models can overlap, with a given model
involving a variety of abstract structures. In general, mathematical
models may include
logical models.
In many cases, the quality of a scientific field depends on how well
the mathematical models developed on the theoretical side agree with
results of repeatable experiments. Lack of agreement between
theoretical mathematical models and experimental measurements often
leads to important advances as better theories are developed.
In the
physical sciences, a traditional mathematical model contains most of the following elements:
- Governing equations
- Supplementary sub-models
- Defining equations
- Constitutive equations
- Assumptions and constraints
- Initial and boundary conditions
- Classical constraints and kinematic equations
Classifications
Mathematical models are usually composed of relationships and
variables. Relationships can be described by
operators, such as algebraic operators, functions, differential operators, etc. Variables are abstractions of system
parameters of interest, that can be
quantified. Several classification criteria can be used for mathematical models according to their structure:
- Linear vs. nonlinear: If all the operators in a mathematical model exhibit linearity,
the resulting mathematical model is defined as linear. A model is
considered to be nonlinear otherwise. The definition of linearity and
nonlinearity is dependent on context, and linear models may have
nonlinear expressions in them. For example, in a statistical linear model,
it is assumed that a relationship is linear in the parameters, but it
may be nonlinear in the predictor variables. Similarly, a differential
equation is said to be linear if it can be written with linear differential operators, but it can still have nonlinear expressions in it. In a mathematical programming model, if the objective functions and constraints are represented entirely by linear equations,
then the model is regarded as a linear model. If one or more of the
objective functions or constraints are represented with a nonlinear equation, then the model is known as a nonlinear model.
Nonlinearity, even in fairly simple systems, is often associated with phenomena such as chaos and irreversibility.
Although there are exceptions, nonlinear systems and models tend to be
more difficult to study than linear ones. A common approach to
nonlinear problems is linearization,
but this can be problematic if one is trying to study aspects such as
irreversibility, which are strongly tied to nonlinearity.
- Static vs. dynamic: A dynamic model accounts for time-dependent changes in the state of the system, while a static
(or steady-state) model calculates the system in equilibrium, and thus
is time-invariant. Dynamic models typically are represented by differential equations or difference equations.
- Explicit vs. implicit: If all of the input parameters of the
overall model are known, and the output parameters can be calculated by a
finite series of computations, the model is said to be explicit. But sometimes it is the output parameters which are known, and the corresponding inputs must be solved for by an iterative procedure, such as Newton's method (if the model is linear) or Broyden's method (if non-linear). In such a case the model is said to be implicit. For example, a jet engine's physical properties such as turbine and nozzle throat areas can be explicitly calculated given a design thermodynamic cycle
(air and fuel flow rates, pressures, and temperatures) at a specific
flight condition and power setting, but the engine's operating cycles at
other flight conditions and power settings cannot be explicitly
calculated from the constant physical properties.
- Discrete vs. continuous: A discrete model treats objects as discrete, such as the particles in a molecular model or the states in a statistical model; while a continuous model
represents the objects in a continuous manner, such as the velocity
field of fluid in pipe flows, temperatures and stresses in a solid, and
electric field that applies continuously over the entire model due to a
point charge.
- Deterministic vs. probabilistic (stochastic): A deterministic
model is one in which every set of variable states is uniquely
determined by parameters in the model and by sets of previous states of
these variables; therefore, a deterministic model always performs the
same way for a given set of initial conditions. Conversely, in a
stochastic model—usually called a "statistical model"—randomness is present, and variable states are not described by unique values, but rather by probability distributions.
- Deductive, inductive, or floating: A deductive model is a
logical structure based on a theory. An inductive model arises from
empirical findings and generalization from them. The floating model
rests on neither theory nor observation, but is merely the invocation of
expected structure. Application of mathematics in social sciences
outside of economics has been criticized for unfounded models. Application of catastrophe theory in science has been characterized as a floating model.
Significance in the natural sciences
Mathematical models are of great importance in the natural sciences, particularly in
physics. Physical
theories are almost invariably expressed using mathematical models.
Throughout history, more and more accurate mathematical models have been developed.
Newton's laws accurately describe many everyday phenomena, but at certain limits
theory of relativity and
quantum mechanics must be used. Though even these theories can't model or explain all phenomena themselves or together, such as
black holes.
It is possible to obtain the less accurate models in appropriate
limits, for example relativistic mechanics reduces to Newtonian
mechanics at speeds much less than the
speed of light. Quantum mechanics reduces to classical physics when the quantum numbers are high. For example, the
de Broglie wavelength of a tennis ball is insignificantly small, so classical physics is a good approximation to use in this case.
It is common to use idealized models in physics to simplify things. Massless ropes, point particles,
ideal gases and the
particle in a box
are among the many simplified models used in physics. The laws of
physics are represented with simple equations such as Newton's laws,
Maxwell's equations and the
Schrödinger equation.
These laws are a basis for making mathematical models of real
situations. Many real situations are very complex and thus modeled
approximate on a computer, a model that is computationally feasible to
compute is made from the basic laws or from approximate models made from
the basic laws. For example, molecules can be modeled by
molecular orbital models that are approximate solutions to the Schrödinger equation. In
engineering, physics models are often made by mathematical methods such as
finite element analysis.
Some applications
Often when engineers analyze a system to be controlled or
optimized, they use a mathematical model. In analysis, engineers can
build a descriptive model of the system as a hypothesis of how the
system could work, or try to estimate how an unforeseeable event could
affect the system. Similarly, in control of a system, engineers can try
out different control approaches in
simulations.
A mathematical model usually describes a system by a
set of variables and a set of equations that establish relationships between the variables. Variables may be of many types;
real or
integer numbers,
boolean values or
strings, for example. The variables represent some properties of the system, for example, measured system outputs often in the form of
signals,
timing data,
counters, and event occurrence (yes/no). The actual model is the set of
functions that describe the relations between the different variables.
Building blocks
Decision variables are sometimes known as independent variables. Exogenous variables are sometimes known as
parameters or
constants.
The variables are not independent of each other as the state variables
are dependent on the decision, input, random, and exogenous variables.
Furthermore, the output variables are dependent on the state of the
system (represented by the state variables).
Objectives and
constraints of the system and its users can be represented as
functions of the output variables or state variables. The
objective functions will depend on the perspective of the model's user. Depending on the context, an objective function is also known as an
index of performance,
as it is some measure of interest to the user. Although there is no
limit to the number of objective functions and constraints a model can
have, using or optimizing the model becomes more involved
(computationally) as the number increases.
A priori information
To
analyse something with a typical "black box approach", only the
behavior of the stimulus/response will be accounted for, to infer the
(unknown) box. The usual representation of this black box system is a data flow diagram centered in the box.
Mathematical modeling problems are often classified into
black box or
white box models, according to how much
a priori
information on the system is available. A black-box model is a system
of which there is no a priori information available. A white-box model
(also called glass box or clear box) is a system where all necessary
information is available. Practically all systems are somewhere between
the black-box and white-box models, so this concept is useful only as an
intuitive guide for deciding which approach to take.
Usually it is preferable to use as much a priori information as
possible to make the model more accurate. Therefore, the white-box
models are usually considered easier, because if you have used the
information correctly, then the model will behave correctly. Often the a
priori information comes in forms of knowing the type of functions
relating different variables. For example, if we make a model of how a
medicine works in a human system, we know that usually the amount of
medicine in the blood is an
exponentially decaying
function. But we are still left with several unknown parameters; how
rapidly does the medicine amount decay, and what is the initial amount
of medicine in blood? This example is therefore not a completely
white-box model. These parameters have to be estimated through some
means before one can use the model.
In black-box models one tries to estimate both the functional
form of relations between variables and the numerical parameters in
those functions. Using a priori information we could end up, for
example, with a set of functions that probably could describe the system
adequately. If there is no a priori information we would try to use
functions as general as possible to cover all different models. An often
used approach for black-box models are
neural networks
which usually do not make assumptions about incoming data.
Alternatively the NARMAX (Nonlinear AutoRegressive Moving Average model
with eXogenous inputs) algorithms which were developed as part of
nonlinear system identification can be used to select the model terms, determine the model structure,
and estimate the unknown parameters in the presence of correlated and
nonlinear noise. The advantage of NARMAX models compared to neural
networks is that NARMAX produces models that can be written down and
related to the underlying process, whereas neural networks produce an
approximation that is opaque.
Subjective information
Sometimes it is useful to incorporate subjective information into a mathematical model. This can be done based on
intuition,
experience, or
expert opinion, or based on convenience of mathematical form.
Bayesian statistics provides a theoretical framework for incorporating such subjectivity into a rigorous analysis: we specify a
prior probability distribution (which can be subjective), and then update this distribution based on empirical data.
An example of when such approach would be necessary is a
situation in which an experimenter bends a coin slightly and tosses it
once, recording whether it comes up heads, and is then given the task of
predicting the probability that the next flip comes up heads. After
bending the coin, the true probability that the coin will come up heads
is unknown; so the experimenter would need to make a decision (perhaps
by looking at the shape of the coin) about what prior distribution to
use. Incorporation of such subjective information might be important to
get an accurate estimate of the probability.
Complexity
In general, model complexity involves a trade-off between simplicity and accuracy of the model.
Occam's razor
is a principle particularly relevant to modeling, its essential idea
being that among models with roughly equal predictive power, the
simplest one is the most desirable. While added complexity usually
improves the realism of a model, it can make the model difficult to
understand and analyze, and can also pose computational problems,
including
numerical instability.
Thomas Kuhn argues that as science progresses, explanations tend to become more complex before a
paradigm shift offers radical simplification.
For example, when modeling the flight of an aircraft, we could
embed each mechanical part of the aircraft into our model and would thus
acquire an almost white-box model of the system. However, the
computational cost of adding such a huge amount of detail would
effectively inhibit the usage of such a model. Additionally, the
uncertainty would increase due to an overly complex system, because each
separate part induces some amount of variance into the model. It is
therefore usually appropriate to make some approximations to reduce the
model to a sensible size. Engineers often can accept some approximations
in order to get a more robust and simple model. For example,
Newton's classical mechanics
is an approximated model of the real world. Still, Newton's model is
quite sufficient for most ordinary-life situations, that is, as long as
particle speeds are well below the
speed of light, and we study macro-particles only.
Training and tuning
Any model which is not pure white-box contains some
parameters that can be used to fit the model to the system it is intended to describe. If the modeling is done by an
artificial neural network or other
machine learning, the optimization of parameters is called
training, while the optimization of model hyperparameters is called
tuning and often uses
cross-validation. In more conventional modeling through explicitly given mathematical functions, parameters are often determined by
curve fitting.
Model evaluation
A
crucial part of the modeling process is the evaluation of whether or
not a given mathematical model describes a system accurately. This
question can be difficult to answer as it involves several different
types of evaluation.
Fit to empirical data
Usually
the easiest part of model evaluation is checking whether a model fits
experimental measurements or other empirical data. In models with
parameters, a common approach to test this fit is to split the data into
two disjoint subsets: training data and verification data. The training
data are used to estimate the model parameters. An accurate model will
closely match the verification data even though these data were not
used to set the model's parameters. This practice is referred to as
cross-validation in statistics.
Defining a
metric
to measure distances between observed and predicted data is a useful
tool of assessing model fit. In statistics, decision theory, and some
economic models, a
loss function plays a similar role.
While it is rather straightforward to test the appropriateness of
parameters, it can be more difficult to test the validity of the
general mathematical form of a model. In general, more mathematical
tools have been developed to test the fit of
statistical models than models involving
differential equations. Tools from
non-parametric statistics
can sometimes be used to evaluate how well the data fit a known
distribution or to come up with a general model that makes only minimal
assumptions about the model's mathematical form.
Scope of the model
Assessing
the scope of a model, that is, determining what situations the model is
applicable to, can be less straightforward. If the model was
constructed based on a set of data, one must determine for which systems
or situations the known data is a "typical" set of data.
The question of whether the model describes well the properties of the system between data points is called
interpolation, and the same question for events or data points outside the observed data is called
extrapolation.
As an example of the typical limitations of the scope of a model, in evaluating Newtonian
classical mechanics,
we can note that Newton made his measurements without advanced
equipment, so he could not measure properties of particles travelling at
speeds close to the speed of light. Likewise, he did not measure the
movements of molecules and other small particles, but macro particles
only. It is then not surprising that his model does not extrapolate well
into these domains, even though his model is quite sufficient for
ordinary life physics.
Philosophical considerations
Many types of modeling implicitly involve claims about
causality.
This is usually (but not always) true of models involving differential
equations. As the purpose of modeling is to increase our understanding
of the world, the validity of a model rests not only on its fit to
empirical observations, but also on its ability to extrapolate to
situations or data beyond those originally described in the model. One
can think of this as the differentiation between qualitative and
quantitative predictions. One can also argue that a model is worthless
unless it provides some insight which goes beyond what is already known
from direct investigation of the phenomenon being studied.
An example of such criticism is the argument that the mathematical models of
optimal foraging theory do not offer insight that goes beyond the common-sense conclusions of
evolution and other basic principles of ecology.
Examples
- One of the popular examples in computer science is the mathematical models of various machines, an example is the deterministic finite automaton
(DFA) which is defined as an abstract mathematical concept, but due to
the deterministic nature of a DFA, it is implementable in hardware and
software for solving various specific problems. For example, the
following is a DFA M with a binary alphabet, which requires that the
input contains an even number of 0s.
M = (Q, Σ, δ, q0, F) where
-
The state S1 represents that there has been an even number of 0s in the input so far, while S2
signifies an odd number. A 1 in the input does not change the state of
the automaton. When the input ends, the state will show whether the
input contained an even number of 0s or not. If the input did contain an
even number of 0s, M will finish in state S1, an accepting state, so the input string will be accepted.
- Many everyday activities carried out without a thought are uses of mathematical models. A geographical map projection of a region of the earth onto a small, plane surface is a model[7] which can be used for many purposes such as planning travel.
- Another simple activity is predicting the position of a vehicle from
its initial position, direction and speed of travel, using the equation
that distance traveled is the product of time and speed. This is known
as dead reckoning
when used more formally. Mathematical modeling in this way does not
necessarily require formal mathematics; animals have been shown to use
dead reckoning.
- Population Growth. A simple (though approximate) model of population growth is the Malthusian growth model. A slightly more realistic and largely used population growth model is the logistic function, and its extensions.
- Model of a particle in a potential-field. In this model we
consider a particle as being a point of mass which describes a
trajectory in space which is modeled by a function giving its
coordinates in space as a function of time. The potential field is given
by a function and the trajectory, that is a function , is the solution of the differential equation:
-
that can be written also as:
-
- Note this model assumes the particle is a point mass, which is
certainly known to be false in many cases in which we use this model;
for example, as a model of planetary motion.
- Model of rational behavior for a consumer. In this model we assume a consumer faces a choice of n commodities labeled 1,2,...,n each with a market price p1, p2,..., pn. The consumer is assumed to have an ordinal utility function U
(ordinal in the sense that only the sign of the differences between two
utilities, and not the level of each utility, is meaningful), depending
on the amounts of commodities x1, x2,..., xn consumed. The model further assumes that the consumer has a budget M which is used to purchase a vector x1, x2,..., xn in such a way as to maximize U(x1, x2,..., xn). The problem of rational behavior in this model then becomes an optimization problem, that is:
-
- subject to:
- This model has been used in a wide variety of economic contexts, such as in general equilibrium theory to show existence and Pareto efficiency of economic equilibria.