User Guide¶
Basic setup¶
Basic mathematical operations involving numbers with uncertainties only require a simple import:
>>> from uncertainties import ufloat
The ufloat()
function creates numbers with uncertainties. Existing
calculation code can usually run with no or little modification and
automatically produce results with uncertainties.
The uncertainties
module contains other features, which can be
made accessible through
>>> import uncertainties
The uncertainties
package also contains sub-modules for
advanced mathematical functions, and
arrays and matrices.
Creating numbers with uncertainties¶
Numbers with uncertainties can be input either numerically, or through one of many string representations, so that files containing numbers with uncertainties can easily be parsed. Thus, x = 0.20±0.01 can be expressed in many convenient ways, including:
>>> x = ufloat(0.20, 0.01) # x = 0.20+/-0.01
>>> from uncertainties import ufloat_fromstr
>>> x = ufloat_fromstr("0.20+/-0.01")
>>> x = ufloat_fromstr("(2+/-0.1)e-01") # Factored exponent
>>> x = ufloat_fromstr("0.20(1)") # Short-hand notation
>>> x = ufloat_fromstr("20(1)e-2") # Exponent notation
>>> x = ufloat_fromstr(u"0.20±0.01") # Pretty-print form
>>> x = ufloat_fromstr("0.20") # Automatic uncertainty of +/-1 on last digit
Each number created this way is an independent (random) variable (for details, see the Technical Guide).
More information can be obtained with pydoc uncertainties.ufloat
and pydoc uncertainties.ufloat_fromstr
(“20(1)×10-2” is
also recognized, etc.).
Basic math¶
Calculations can be performed directly, as with regular real numbers:
>>> square = x**2
>>> print square
0.040+/-0.004
Mathematical operations¶
Besides being able to apply basic mathematical operations to numbers
with uncertainty, this package provides generalizations of most of
the functions from the standard math
module. These
mathematical functions are found in the uncertainties.umath
module:
>>> from uncertainties.umath import * # Imports sin(), etc.
>>> sin(x**2)
0.03998933418663417+/-0.003996800426643912
The list of available mathematical functions can be obtained with the
pydoc uncertainties.umath
command.
Arrays of numbers with uncertainties¶
It is possible to put numbers with uncertainties in NumPy arrays and matrices:
>>> arr = numpy.array([ufloat(1, 0.01), ufloat(2, 0.1)])
>>> 2*arr
[2.0+/-0.02 4.0+/-0.2]
>>> print arr.sum()
3.00+/-0.10
Thus, usual operations on NumPy arrays can be performed transparently even when these arrays contain numbers with uncertainties.
More complex operations on NumPy arrays and matrices can be
performed through the dedicated uncertainties.unumpy
module.
Printing¶
Numbers with uncertainties can be printed conveniently:
>>> print x
0.200+/-0.010
The resulting form can generally be parsed back with
ufloat_fromstr()
(except for the LaTeX form).
The nominal value and the uncertainty always have the same precision: this makes it easier to compare them.
More control over the format can be obtained (in Python 2.6+)
through the usual format()
method of strings:
>>> print 'Result = {:10.2f}'.format(x)
Result = 0.20+/- 0.01
(Python 2.6 requires '{0:10.2f}'
instead, with the usual explicit
index. In Python 2.5 and earlier versions, str.format()
is not
available, but one can use the format()
method of numbers with
uncertainties instead: 'Result = %s' % x.format('10.2f')
.)
All the float format specifications are accepted, except those
with the n
format type. In particular, a fill character, an
alignment option, a sign or zero option, a width, or the %
format
type are all supported.
When uncertainties
must choose the number of significant
digits on the uncertainty, it is defined with the Particle
Data Group rounding
rules (these rules keep the number of digits small, which is
convenient for reading numbers with uncertainties, and at the same
time prevent the uncertainty from being displayed with too few
digits):
>>> print 'Automatic number of digits on the uncertainty: {}'.format(x)
Automatic number of digits on the uncertainty: 0.200+/-0.010
>>> print x
0.200+/-0.010
It is possible to control the number of significant digits of the
uncertainty by adding the precision modifier u
after the
precision (and before any valid float format type like f
, e
,
the empty format type, etc.):
>>> print '1 significant digit on the uncertainty: {:.1u}'.format(x)
1 significant digit on the uncertainty: 0.20+/-0.01
>>> print '3 significant digits on the uncertainty: {:.3u}'.format(x)
3 significant digits on the uncertainty: 0.2000+/-0.0100
>>> print '1 significant digit, exponent notation: {:.1ue}'.format(x)
1 significant digit, exponent notation: (2.0+/-0.1)e-01
>>> print '1 significant digit, percentage: {:.1u%}'.format(x)
1 significant digit, percentage: (20+/-1)%
The usual float formats with a precision retain their original
meaning (e.g. .2e
uses two digits after the decimal point): code
that works with floats produces similar results when running with
numbers with uncertainties.
A common exponent is automatically calculated if an exponent is needed for the larger of the nominal value (in absolute value) and the uncertainty (the rule is the same as for floats). The exponent is generally factored, for increased legibility:
>>> print x*1e7
(2.00+/-0.10)e+06
When a format width is used, the common exponent is not factored:
>>> print 'Result = {:10.1e}'.format(x*1e-10)
Result = 2.0e-11+/- 0.1e-11
(Using a (minimal) width of 1 is thus a way of forcing exponents to not be factored.) Thanks to this feature, each part (nominal value and standard deviation) is correctly aligned across multiple lines, while the relative magnitude of the error can still be readily estimated thanks to the common exponent.
Formatting options can be added at the end of the format string: S
for the shorthand notation, L
for a LaTeX output, P
for pretty-printing:
>>> print '{:+.1uS}'.format(x) # Sign, 1 digit for the uncertainty, shorthand
+0.20(1)
>>> print '{:L}'.format(x*1e7) # Automatic exponent form, LaTeX
\left(2.00 \pm 0.10\right) \times 10^{6}
The pretty-printing mode uses “±” and superscript exponents: the
default output is such that print '{:.2e}'.format(x)
yields
“(2.00+/-0.10)e-01”, whereas the pretty-printing mode in print
u'{:.2eP}'.format(x)
yields “(2.00±0.10)×10-1”. Note that
the pretty-printing mode implies using Unicode format strings
(u'…'
in Python 2, but simply '…'
in Python 3).
These formatting options can be combined (when meaningful).
An uncertainty which is exactly zero is always formatted as an integer:
>>> print ufloat(3.1415, 0)
3.1415+/-0
>>> print ufloat(3.1415e10, 0)
(3.1415+/-0)e+10
>>> print ufloat(3.1415, 0.0005)
3.1415+/-0.0005
>>> print '{:.2f}'.format(ufloat(3.14, 0.001))
3.14+/-0.00
>>> print '{:.2f}'.format(ufloat(3.14, 0.00))
3.14+/-0
All the digits of a number with uncertainty are given in its representation:
>>> y = ufloat(1.23456789012345, 0.123456789)
>>> print y
1.23+/-0.12
>>> print repr(y)
1.23456789012345+/-0.123456789
>>> y
1.23456789012345+/-0.123456789
More information on formatting can be obtained with pydoc
uncertainties.UFloat.__format__
(customization of the LaTeX output,
etc.).
Global formatting¶
It is sometimes useful to have a consistent formatting across multiple parts of a program. Python’s string.Formatter class allows one to do just that. Here is how it can be used to consistently use the shorthand notation for numbers with uncertainties:
class ShorthandFormatter(string.Formatter):
def format_field(self, value, format_spec):
if isinstance(value, uncertainties.UFloat):
return value.format(format_spec+'S') # Shorthand option added
# Special formatting for other types can be added here (floats, etc.)
else:
# Usual formatting:
return super(ShorthandFormatter, self).format_field(
value, format_spec)
frmtr = ShorthandFormatter()
print frmtr.format("Result = {0:.1u}", x) # 1-digit uncertainty
prints with the shorthand notation: Result = 0.20(1)
.
Access to the uncertainty and to the nominal value¶
The nominal value and the uncertainty (standard deviation) can also be accessed independently:
>>> print square
0.040+/-0.004
>>> print square.nominal_value
0.04
>>> print square.n # Abbreviation
0.04
>>> print square.std_dev
0.004
>>> print square.s # Abbreviation
0.004
Access to the individual sources of uncertainty¶
The various contributions to an uncertainty can be obtained through the
error_components()
method, which maps the independent variables
a quantity depends on to their contribution to the total
uncertainty. According to linear error propagation theory (which is the method followed by uncertainties
),
the sum of the squares of these contributions is the squared
uncertainty.
The individual contributions to the uncertainty are more easily usable when the variables are tagged:
>>> u = ufloat(1, 0.1, "u variable") # Tag
>>> v = ufloat(10, 0.1, "v variable")
>>> sum_value = u+2*v
>>> sum_value
21.0+/-0.223606797749979
>>> for (var, error) in sum_value.error_components().items():
... print "{}: {}".format(var.tag, error)
...
u variable: 0.1
v variable: 0.2
The variance (i.e. squared uncertainty) of the result
(sum_value
) is the quadratic sum of these independent
uncertainties, as it should be (0.1**2 + 0.2**2
).
The tags do not have to be distinct. For instance, multiple random
variables can be tagged as "systematic"
, and their contribution to
the total uncertainty of result
can simply be obtained as:
>>> syst_error = math.sqrt(sum( # Error from *all* systematic errors
... error**2
... for (var, error) in result.error_components().items()
... if var.tag == "systematic"))
The remaining contribution to the uncertainty is:
>>> other_error = math.sqrt(result.std_dev**2 - syst_error**2)
The variance of result
is in fact simply the quadratic sum of
these two errors, since the variables from
result.error_components()
are independent.
Comparison operators¶
Comparison operators behave in a natural way:
>>> print x
0.200+/-0.010
>>> y = x + 0.0001
>>> y
0.2001+/-0.01
>>> y > x
True
>>> y > 0
True
One important concept to keep in mind is that ufloat()
creates a
random variable, so that two numbers with the same nominal value and
standard deviation are generally different:
>>> y = ufloat(1, 0.1)
>>> z = ufloat(1, 0.1)
>>> print y
1.00+/-0.10
>>> print z
1.00+/-0.10
>>> y == y
True
>>> y == z
False
In physical terms, two rods of the same nominal length and uncertainty
on their length are generally of different sizes: y
is different
from z
.
More detailed information on the semantics of comparison operators for numbers with uncertainties can be found in the Technical Guide.
Covariance and correlation matrices¶
Covariance matrix¶
The covariance matrix between various variables or calculated quantities can be simply obtained:
>>> sum_value = u+2*v
>>> cov_matrix = uncertainties.covariance_matrix([u, v, sum_value])
has value
[[0.01, 0.0, 0.01],
[0.0, 0.01, 0.02],
[0.01, 0.02, 0.05]]
In this matrix, the zero covariances indicate that u
and v
are
independent from each other; the last column shows that sum_value
does depend on these variables. The uncertainties
package
keeps track at all times of all correlations between quantities
(variables and functions):
>>> sum_value - (u+2*v)
0.0+/-0
Correlated variables¶
Reciprocally, correlated variables can be created transparently, provided that the NumPy package is available.
Use of a covariance matrix¶
Correlated variables can be obtained through the covariance matrix:
>>> (u2, v2, sum2) = uncertainties.correlated_values([1, 10, 21], cov_matrix)
creates three new variables with the listed nominal values, and the given covariance matrix:
>>> sum_value
21.0+/-0.223606797749979
>>> sum2
21.0+/-0.223606797749979
>>> sum2 - (u2+2*v2)
0.0+/-3.83371856862256e-09
The theoretical value of the last expression is exactly zero, like for
sum - (u+2*v)
, but numerical errors yield a small uncertainty
(3e-9 is indeed very small compared to the uncertainty on sum2
:
correlations should in fact cancel the uncertainty on sum2
).
The covariance matrix is the desired one:
>>> uncertainties.covariance_matrix([u2, v2, sum2])
reproduces the original covariance matrix cov_matrix
(up to
rounding errors).
Use of a correlation matrix¶
Alternatively, correlated values can be defined through a correlation matrix (the correlation matrix is the covariance matrix normalized with individual standard deviations; it has ones on its diagonal), along with a list of nominal values and standard deviations:
>>> (u3, v3, sum3) = uncertainties.correlated_values_norm(
... [(1, 0.1), (10, 0.1), (21, 0.22360679774997899)], corr_matrix)
>>> print u3
1.00+/-0.10
The three returned numbers with uncertainties have the correct
uncertainties and correlations (corr_matrix
can be recovered
through correlation_matrix()
).
Making custom functions accept numbers with uncertainties¶
This package allows code which is not meant to be used with numbers with uncertainties to handle them anyway. This is for instance useful when calling external functions (which are out of the user’s control), including functions written in C or Fortran. Similarly, functions that do not have a simple analytical form can be automatically wrapped so as to also work with arguments that contain uncertainties.
It is thus possible to take a function f()
that returns a
single float, and to automatically generalize it so that it also
works with numbers with uncertainties:
>>> wrapped_f = uncertainties.wrap(f)
The new function wrapped_f()
accepts numbers with uncertainties
as arguments wherever a Python float is used for f()
.
wrapped_f()
returns the same values as f()
, but with
uncertainties.
With a simple wrapping call like above, uncertainties in the function
result are automatically calculated numerically. Analytical
uncertainty calculations can be performed if derivatives are
provided to wrap()
.
More details are available in the documentation string of wrap()
(accessible through the pydoc
command, or Python’s help()
shell function).
Miscellaneous utilities¶
It is sometimes useful to modify the error on certain parameters so as to study its impact on a final result. With this package, the uncertainty of a variable can be changed on the fly:
>>> sum_value = u+2*v
>>> sum_value
21.0+/-0.223606797749979
>>> prev_uncert = u.std_dev
>>> u.std_dev = 10
>>> sum_value
21.0+/-10.00199980003999
>>> u.std_dev = prev_uncert
The relevant concept is that sum_value
does depend on the
variables u
and v
: the uncertainties
package keeps
track of this fact, as detailed in the Technical Guide, and uncertainties can thus be updated at any time.
When manipulating ensembles of numbers, some of which contain
uncertainties while others are simple floats, it can be useful to
access the nominal value and uncertainty of all numbers in a uniform
manner. This is what the nominal_value()
and
std_dev()
functions do:
>>> print uncertainties.nominal_value(x)
0.2
>>> print uncertainties.std_dev(x)
0.01
>>> uncertainties.nominal_value(3)
3
>>> uncertainties.std_dev(3)
0.0
Finally, a utility method is provided that directly yields the
standard score
(number of standard deviations) between a number and a result with
uncertainty: with x
equal to 0.20±0.01,
>>> x.std_score(0.17)
-3.0
Derivatives¶
Since the application of linear error propagation theory involves the calculation of derivatives, this package automatically performs such calculations; users can thus easily get the derivative of an expression with respect to any of its variables:
>>> u = ufloat(1, 0.1)
>>> v = ufloat(10, 0.1)
>>> sum_value = u+2*v
>>> sum_value.derivatives[u]
1.0
>>> sum_value.derivatives[v]
2.0
These values are obtained with a fast differentiation algorithm.
Additional information¶
The capabilities of the uncertainties
package in terms of array
handling are detailed in Uncertainties in arrays.
Details about the theory behind this package and implementation information are given in the Technical Guide.