1. Introduction
The geometric approaches to thermodynamics and statistical mechanics have been developed since the early works of Gibbs [
1] and Carathéodory [
2]. Ruppeiner [
3] and Weinhold [
4,
5] independently introduced the Riemannian metrics, which are constructed from thermodynamic potentials (entropy or internal energy). The thermodynamic fluctuations around the equilibrium states have been studied, and the associated Riemannian curvature has been related to an interaction that characterizes a thermodynamic system. On the other hand, information geometry [
6] has been developed mainly in the fields of statistics, and it provides a useful framework for studying the family of probability distributions, mainly the exponential family, by using the geometric tools in affine differential geometry. One of the distinct features in information geometry is a dualistic structure of affine connections, which provides us a very useful tool for many scientific fields, such as information theory, statistics, neural networks, statistical physics, and so on.
Recently, for studying power law distributions, some deformed exponential families [
7,
8] have attracted attention in various scientific fields. Among the deformed exponential functions, the
κ-deformed exponential function [
9] was proposed recently and has been developed in many fields, such as statistical physics [
9,
10,
11,
12], thermostatistics, financial physics, social science, statistics, information theory and information geometry [
13]. Although the physical meaning of the deformed parameter
κ is not established yet, some theoretical foundations [
14] of the
κ-deformed exponential functions have been developed.
The
κ-thermostatistics is a generalization of thermostatistics [
15] based on
κ-entropy
, which reduces to the standard Gibbs–Shannon entropy in the limit of
. Since a deformed exponential probability density function (pdf) naturally induces the escort pdf [
8] in general, the
κ-deformed exponential pdf also leads to the
κ-escort pdf. As a result, it is important to take into account the two different kinds of expectations: one is the
κ-escort expectation, and the other is the standard expectation. Accordingly, the
κ-entropy
, which is defined by the standard expectation, naturally induces the
κ-escort entropy, which is expressed as the
κ-escort expectation. While two of the authors (Tatsuaki Wada and Antonio M. Scarfone) studied the information geometric structures [
13,
16] of the
κ-thermostatistics, the other author (Hiroshi Matsuzoe) showed that a deformed exponential family has two kinds of dualistic Hessian structures [
17] in general. We here explore the information geometric structures concerning the
κ-thermostatistics. Remarkably, as shown in this paper, there exist two different kinds of dualistic Hessian structures among the thermodynamic potentials in the
κ-thermostatistics.
In the next section, we begin with a brief review of the geometric approach to thermodynamics and Callen’s thermostatistics [
15].
Section 3 provides the preliminaries on the Hessian geometry concerning the information geometry based on the exponential family. It also provides the very basics of the
κ-thermostatistics. In
Section 4, we explain the dualistic structures of the Hessian geometries in the
κ-thermostatistics. We explore the Hessian structure associated with the Legendre relations for the
κ-entropy. We derive some non-trivial relations, which disappear in the standard limit of
. The final section is devoted to the conclusions.
2. Thermodynamics and Thermostatistics
Consider a thermal equilibrium system characterized by the entropy
S as a state function of the internal energy
U and volume
V,
i.e., in entropy representation
. We assume that the thermal system has a fixed number of particles. As is well known, the first law of thermodynamics is expressed as:
where
T and
P denote the temperature and the pressure of the thermal system, respectively. They are related by the relations:
Mathematically, these relations are necessary and sufficient conditions, so that the Pfaff equation
is an exact differential, and consequently, the entropy
is a state function, as shown originally by Carathéodory [
2]. Planck potential Ξ is given by:
which is nothing but the total Legendre transform of
.
For the sake of later convenience, instead of the concave function
, we use the convex function
, which is called negentropy, or negative entropy [
18]. Introducing the set of the extensive variables
with
, and the set of the intensive variables
with
, Relations (
2) can be compactly expressed as:
where
. The Legendre relation (
3) becomes:
and the dual relation of (
4) is readily obtained from (
5) as:
where
.
It is also known that the Maxwell relations in thermodynamics are due to the irrelevance of the order of differentiating a thermodynamic potential (an analytic function) with respect to two variables, For instance, for the negentropy
, the following Maxwell relation:
is equivalent to the relation:
The Hessian of the negentropy
can be considered as a symmetric metric tensor of a manifold with the thermodynamic variables
as its coordinates,
which is equivalent to the Ruppeiner metric [
3]. The inverse matrix of
is given by:
In Callen’s thermostatistics [
15], the concept of the equilibrium states in conventional thermal physics is extended to the “equilibrium states”, which are characterized as the states that maximize the disorder, or the measure of information. A well-known measure of information is the Gibbs–Shannon entropy
S, which is expressed as the expectation of
,
i.e.,
Here and hereafter,
stands for the standard expectation with respect to a pdf
, which is characterized by the parameter
with an appropriate degree of freedom
M. Any extensive thermal quantity is considered as the expectation (or average) of the corresponding microscopic quantity, for instance the internal energy is given by:
where
is the microscopic energy of a configuration
x and
is a pdf depending on the intensive parameters
T and
P. Introducing the notation
for the microscopic quantity associated with
, we can express the extensive thermal quantities as:
From the Legendre transformation (
5) and Equation (
13), we see that:
We thus obtain that:
and consequently, we see that the
is an exponential pdf:
The quantity:
is called the score function in statistics, and it has zero expectation,
i.e.,
which is due to the normalization
of any pdf
. From this, we readily confirm Relation (
6) as:
Let us introduce Fisher’s information matrix
defined by:
Differentiating both sides of Equation (
18) with respect to
θ, we obtain:
Using this relation, the Fisher metric
can be written equivalently in other different expressions:
In particular, substituting Equation (
15) into (23), we readily confirm that:
that is this Fisher metric for the exponential pdf (
16) is a Hessian matrix and coincides with the inverse matrix of Ruppeiner metric
.
4. Dual Structures of the Hessian Geometries in the κ-Thermostatistics
In [
16,
19], we have derived the Legendre relations from the
κ-deformed exponential pdf (see Equation (59)), which maximizes the
κ-entropy
under the constraints:
and the normalization of the pdf. Here, we follow the reverse order of the above derivation,
i.e., starting from the Legendre relations, we derive the
κ-deformed exponential pdf. We assume the Legendre relations for the
θ- and
η- potential functions
and
:
with
and recognizing the potential functions as:
Then, we can derive the
κ-deformed exponential pdf as follows. Using the useful Identity (48), we see that:
Comparing the both sides, we obtain that:
from which the
κ-deformed exponential pdf:
is derived. Note that unlike in the standard case in which a relevant pdf is exponential, the parameter
is not necessarily intensive and the variable
is not necessarily extensive in general. In order to avoid misleading, we call
an external parameter, which characterize a state of the thermal systems described by the
κ-deformed exponential pdf (59), and we call
an expectation variable.
For a deformed exponential pdf, it is known [
8] that the so-called escort pdf is naturally induced. We thus introduce the
κ-escort pdf
[
13] with respect to
by:
where
is the normalization factor:
and the corresponding
κ-escort expectation
of a function
is defined by:
Having described the basics concerning
κ-thermostatistics, we now consider its Hessian geometry. The next theorem relates a generalized score function
to the generalized pdf
for which the expectation of
becomes zero. This zero-expectation of a generalized score function
is an important and useful property, which correctly leads to the Legendre relations between an expectation value
and the relevant thermodynamic potential, as shown in (
19) for the standard score function (
17).
Theorem 1. For the general score function in the form:with a given smooth differentiable functional of a pdf ,
the expectation of with respect to the becomes zero if we choose:where denotes the inverse function of .
Proof. For any pdf
,
because of the normalization
. Then:
if the condition:
is satisfied. This means that:
Needless to say, an appropriate proportional factor is needed for the normalization of
. ☐
A well-known example is given by
,
i.e., the score function of (
17). In this case,
, and Relation (
18) is satisfied.
Now, let us introduce the
κ-generalization
of
:
which reduces to
in the limit of
. The inverse function of
is:
and by using the relation:
we have:
which is the
κ-escort pdf Equation (60).
From Theorem 1, we see that the
κ-score function
has zero
κ-escort expectation:
In addition, for the
κ-exponential pdf (59), the
κ-score function
becomes:
and consequently, we have:
where
is the dual coordinate of
associated with the
κ-escort expectations
. Note also that the function
is the
θ-potential function associated with the
κ-escort expectations
. In this way, we have two different kinds of dual coordinates
and
for the same
coordinate. We also see that:
where in the last step, we used:
The Legendre relations concerning
are summarized as follows:
Of course, in the
limit, they reduce to the standard relations, respectively. Note that
is the
κ-escort entropy, which is given by the
κ-escort expectation.
Due to Equation (72), the
κ-score function
has non-zero expectation:
in other words, it is biased. We then introduce the bias correction term
as:
However, as we will show below, it is remarkable that the bias correction term is expressed in terms of the function
in Equation (47).
Theorem 2. For the κ-score function with the κ-generalized representation of Equation (68), the bias correction term is:where is the expectation of .
Proof. The direct calculation shows that:
where we used the useful identities (48) and (49). ☐
We hence introduce the modified
κ-representation:
and the modified
κ-score function given by:
which of course, has zero expectation:
by construction. Note that the modified
κ-representation
reduces to the standard one
in the limit of
, because of
.
With the help of Equation (
55), we can derive the following relations:
and from Equations (86) and (88), we confirm Relation (
55) as:
Now, taking the expectation of the both sides of Equation (73) and using (74) and (82), we obtain the important relation:
Thus, the
θ-derivatives of the function
characterizes the difference between the standard and
κ-escort expectations. This sheds light for understanding a physical role of the
function. Note that since
, the difference of the both expectations disappears in the standard limit of
.
We now consider the
κ-generalized metric, which is the Hessian matrix of the
κ-deformed
θ-potential function:
Accounting for Relation (
55), we can rewrite Equation (92) as:
and taking into account the relation:
we obtain:
which states that the response function
associated with the expectation
is related to the fluctuation associated with the
κ-escort expectation. This is a
κ-generalization of the standard fluctuation-response relation, as pointed out firstly by Naudts [
8]. In the previous work [
16], we applied the result (95) to a
κ-generalization of the grand-canonical ensemble. We emphasized that the response functions for the standard expectations are related to the
κ-escort expectations of the fluctuations around the
κ-escort expectations.
Similarly, we next consider the
κ-generalized escort metric, which is the Hessian matrix of the
κ-escort
θ-potential function
:
Taking the derivative of the normalization factor
of (61) with respect to
, and using Relations (48), (49) and (94), we obtain:
Similar to Relation (95), which relates the metric
to the thermodynamic fluctuations associated with the
κ-escort expectation, we can relate the metric
to a certain kind of thermodynamic fluctuation. To this end, based on Relation (97), we introduce the double-escort pdf
defined by:
which is the escort pdf of the
κ-escort pdf (60), and
denotes the normalization factor:
The double-escort
κ-expectation
of a function
is defined by:
By using the double-escort
κ-expectation, Relation (97) is expressed as:
which is similar to Relation (91), and we see that the
η-derivatives of the normalization factor
characterize the difference between the double-escort
κ-expectation and the
κ-escort expectation.
By using the double-escort pdf, we obtain:
Substituting Relation (101) into this and after some calculations, we finally obtain that:
which is the
κ-generalization of the fluctuation-response relation associated with the double-escort
κ-expectations. To the best of our knowledge, this is the first report to show Relation (103) in the literature.
Next, similar to the representation
, we consider the quantity:
as the co-representation of
. From Relation (58), we see that:
We think that this new quantity represents a certain kind of fluctuation characterized by the deformed parameter
κ. The difference between the expectation of
and that of
is:
Note that this relation is non-trivial unless
and in the limit of
Relation (106) reduces to the definition
.
Taking the
κ-escort expectation of (105), we see that:
which states that the normalization factor
of the
κ-escort pdf characterizes the expectation of the above fluctuations. Next, taking derivative of
with respect to
, we have:
Then, the expectation of the tangent vector
becomes:
which is the corresponding relation to (82).
Finally, we derive the canonical divergences for the two dualistic Hessian structures. For the
κ-deformed exponential pdf
and an arbitrary pdf
, we have:
Then, the canonical divergence [
13] associated with the potential functions
and
becomes:
which reduces to the KL divergence (
39) in the limit of
.
Similarly, for the
κ-deformed exponential pdf
and an arbitrary pdf
, we have:
where
denotes the
κ-escort expectation with respect to
. Then, the canonical divergence associated with the potential functions
and
becomes:
which also reduces to the KL divergence Equation (
39) in the limit of
.