Information processing apparatus, information processing method, and information processing program
11579102 · 2023-02-14
Assignee
Inventors
Cpc classification
C09K5/042
CHEMISTRY; METALLURGY
G16C20/30
PHYSICS
G16C20/10
PHYSICS
G01N25/22
PHYSICS
International classification
G01N25/22
PHYSICS
Abstract
An information processing method is performed by a computer for evaluating flammability of a mixed refrigerant material containing a plurality of components. The method includes: calculating, for each of the plurality of components, a second value obtained by multiplying a mixture ratio thereof in the mixed refrigerant material by a first value obtained based on numbers of hydrogen atoms, halogen atoms, and double bonds included in a molecular structure thereof; calculating a total sum of the second value calculated for each of the plurality of components; and classifying the mixed refrigerant material into a predetermined flammability class based on the total sum.
Claims
1. An information processing apparatus for evaluating flammability of a mixed refrigerant material containing a plurality of components, the information processing apparatus comprising: a memory; and a processor coupled to the memory and configured to perform to: calculate, for each of the plurality of components, a second value obtained by multiplying a mixture ratio thereof in the mixed refrigerant material by a first value obtained based on numbers of hydrogen atoms, halogen atoms, and double bonds included in a molecular structure thereof; calculate a total sum of the second value calculated for each of the plurality of components; and classify the mixed refrigerant material into a predetermined flammability class based on the total sum.
2. The information processing apparatus according to claim 1, wherein the first value is inversely proportional to a value obtained by subtracting the number of double bonds from a number of single bonds included in the molecular structure.
3. The information processing apparatus according to claim 1, wherein the first value is inversely proportional to a value obtained by subtracting the number of double bonds from a sum of the number of hydrogen atoms and a value obtained by multiplying the number of halogen atoms by a coefficient larger than 1.
4. The information processing apparatus according to claim 3, wherein the total sum is defined by
5. The information processing apparatus according to claim 4, wherein the coefficient α is 10 or more.
6. An information processing method, performed by a computer, for evaluating flammability of a mixed refrigerant material containing a plurality of components, the method comprising: calculating, for each of the plurality of components, a second value obtained by multiplying a mixture ratio thereof in the mixed refrigerant material by a first value obtained based on numbers of hydrogen atoms, halogen atoms, and double bonds included in a molecular structure thereof; calculating a total sum of the second value calculated for each of the plurality of components; and classifying the mixed refrigerant material into a predetermined flammability class based on the total sum.
7. A computer readable non-transitory storage medium storing a program for causing a computer to perform a process for evaluating flammability of a mixed refrigerant material containing a plurality of components, the process comprising: calculating, for each of the plurality of components, a second value obtained by multiplying a mixture ratio thereof in the mixed refrigerant material by a first value obtained based on numbers of hydrogen atoms, halogen atoms, and double bonds included in a molecular structure thereof; calculating a total sum of the second value calculated for each of the plurality of components; and classifying the mixed refrigerant material into a predetermined flammability class based on the total sum.
Description
BRIEF DESCRIPTION OF DRAWINGS
(1)
(2)
(3)
(4)
(5)
(6)
(7)
(8)
(9)
DESCRIPTION OF EMBODIMENTS
(10) An information processing apparatus according to a first embodiment will be described. The information processing apparatus according to the first embodiment is an apparatus for evaluating the flammability of a mixed refrigerant material.
(11)
(12) The input parameter obtaining unit 11 reads input parameters 110 stored in the storage unit 100. The input parameters 110 read by the input parameter obtaining unit 11 are sent to the flammability evaluation index calculation unit 12 as variables of a flammability evaluation index A.sub.m that will be described later. The flammability evaluation index calculation unit 12 calculates the flammability evaluation index A.sub.m based on the input parameters 110 that have been sent thereto. The storage unit 100 stores the flammability evaluation index A.sub.m calculated by the flammability evaluation index calculation unit 12 as an output parameter 120.
(13) The storage unit 100 stores, as the input parameters 110, the number n of mixture components, a chemical formula of a mixture component i, a mixture ratio y.sub.i of the mixture component i, and a coefficient α of the flammability evaluation index A.sub.m, which are information related to components of a mixed refrigerant material whose flammability is to be evaluated.
(14) The input parameter obtaining unit 11 and the flammability evaluation index calculation unit 12 are, for example, a central processing unit (CPU). The storage unit 100 is, for example, a random-access memory (RAM) or a hard disk.
(15) A flammability evaluation method according to a comparative example of an information processing apparatus will be described. In the flammability evaluation method according to the comparative example, the total sum of values of respective components of the mixed refrigerant material each of which is obtained by multiplying the flammability class of the mixture component i determined by the combustion test by the mixture ratio y.sub.i of the mixture component i is calculated as the flammability evaluation index A.sub.m. The flammability evaluation index A.sub.m is expressed by the following formula (1), where C.sub.i represents the flammability class of the mixture component i and y.sub.i represents the mixture ratio of the mixture component i.
(16)
(17) The flammability evaluation method according to the comparative example is realized by the mixed refrigerant flammability evaluation apparatus 10 in which the number n of mixture components and the flammability class of the mixture component i are stored in the storage unit 100 as the input parameters 110.
(18)
A.sub.m=A.sub.m+C.sub.iy.sub.i (2)
(19) A.sub.m on the right side of the formula (2) is the value of the flammability evaluation index calculated by iterative processing. Next, i is incremented (step S11). Next, it is determined whether or not i≤n holds, as a branching condition of the iterative processing (step S13). n represents the number of mixture components contained in the mixed refrigerant material to be evaluated. When i≤n holds (step S13: YES), the processing of steps S5 to S11 is repeated. When i≤n does not hold (step S13: NO), the iterative processing is ended, and the flammability evaluation index A.sub.m is output (step S15). The output flammability evaluation index A.sub.m is stored in the storage unit 100 as the output parameter 120.
(20)
(21) In the combustion experiment, the combustion heat and the combustion limit air volume ratio are measured by igniting a flask filled with the target material. The flammability of the refrigerant material is classified based on the measured combustion heat and combustion limit air volume ratio with reference to the standards of the international standard ISO817.
(22) As illustrated in
(23) The reason why the classification error occurs 11 times is considered to be because there is a difference in flammability between pure refrigerant materials classified into the same flammability class 2.
(24) If the classification error occurs 10 or more times when it is desired to obtain which mixed refrigerant material belongs to the flammability class 1 by prediction, time required for additional combustion experiments for verifying the prediction becomes enormous. The aforementioned combustion experiment require about 10 minutes for one mixed refrigerant material. Therefore, extra time is required for the additional combustion experiments for verifying the prediction. The flammability evaluation using the flammability evaluation index A.sub.m calculated according to the processing procedure of the comparative example of the information processing apparatus has low accuracy and is insufficient as a basis for predicting the flammability.
(25) Next, a method for evaluating the flammability of the information processing apparatus according to the first embodiment will be described. In the flammability evaluation method according to the first embodiment, the total sum of values of respective components of the mixed refrigerant material each of which is obtained by multiplying a value obtained based on the numbers of hydrogen atoms, halogen atoms, and double bonds included in the molecular structure of the mixture component i by the mixture ratio y.sub.i of the mixture component i is calculated as the flammability evaluation index A.sub.m. The flammability evaluation index A.sub.m is represented by the following formula (3), where H.sub.i represents the number of hydrogen atoms included in the molecular structure of the mixture component i, F.sub.i represents the number of halogen atoms included in the molecular structure of the mixture component i, and d.sub.i represents the number of double bonds included in the molecular structure of the mixture component i.
(26)
(27) The larger the value of the formula (3) is, the higher the flammability of the mixed refrigerant material is. The flammability evaluation index A.sub.m is not limited to the value represented by the formula (3) described above, and may be the total sum of values each of which is obtained by multiplying a value obtained based on the numbers of hydrogen atoms, halogen atoms, and double bonds included in the molecular structure of each of the plurality of components of the mixed refrigerant material by the mixture ratio of each of the plurality of components.
(28) In particular, based on the finding that a material including more double bonds is more flammable, it is desirable that the obtained value is inversely proportional to a value obtained by subtracting the number of double bonds from the number of single bonds included in the molecular structure, from the viewpoint of improving the accuracy of evaluation of the flammability of the mixed refrigerant material. In the formula (3), since d.sub.i is present in the denominator, the obtained value is inversely proportional to the number of single bonds included in the molecular structure, that is, to a value obtained by subtracting the number of double bonds from the number of hydrogen atoms and the number of halogen atoms. This indicates that decrease in the flammability according to increase in the number of single bonds is relieved according to the number of double bonds. When the number of single bonds increases and the molecular weight increases, the intermolecular force becomes stronger and the reactivity becomes lower. When a double bond is included in the molecular structure, since the reactivity between a double bond and oxygen is high, the flammability is higher than in the case where only single bonds are included.
(29) Based on the finding that decrease in the flammability according to increase in the number of halogen atoms is greater than that according to increase in the number of hydrogen atoms, it is desirable that the obtained value is inversely proportional to a value obtained by subtracting the number of double bonds from the sum of the number of hydrogen atoms and a value obtained by multiplying the number of halogen atoms by a coefficient larger than 1, from the viewpoint of improving the accuracy of evaluation of the flammability of the mixed refrigerant material. In the formula (3), the number F.sub.i of halogen atoms in the denominator is multiplied by a coefficient α larger than 1, so that the influence of the decrease in the flammability caused by halogen may be reflected. Halogen is stronger in electronegativity than hydrogen and it is more difficult to break a bond thereof, so that the energy required for combustion is large. The influence of the number of halogen atoms on the flammability is greater than that of hydrogen, and is evaluated in the flammability evaluation index A.sub.m with a larger weight. The coefficient α of the formula (3) is preferably 10 or more for improving prediction accuracy.
(30) The number d.sub.i of double bonds included in the formula (3) is represented by the following formula (4), where C.sub.i represents the number of carbon atoms contained in the molecular structure of the mixture component i.
(31)
(32)
(33) As illustrated in
(34) The molecular structure is determined by, for example, performing character recognition on the molecular formula of the mixture component i stored in the storage unit 100 as the input parameters 110. When the molecular structure of the mixture component i includes a character other than “C”, “H”, “F”, and “Cl” (step S17: YES), the processing is ended. For the mixture component i containing a character other than “C”, “H”, “F”, and “Cl” in the molecular structure, exception processing of the flammability evaluation is performed. When the molecular structure of the mixture component i does not include a character other than “C”, “H”, “F”, “Cl” (step S17: NO), the input parameter obtaining unit 11 obtains the atom numbers c, h, f, and cl of “C”, “H”, “F”, and “Cl”, respectively (step S21). The atom numbers c, h, f, and cl may be obtained, for example, from the subscripts of the molecular formula.
(35) The input parameter obtaining unit 11 determines the number C.sub.i of carbon atoms, the number H.sub.i of hydrogen atoms, and the number F.sub.i of halogen atoms included in the molecular structure of the mixture component i based on the atom numbers c, h, f, and cl obtained in step S21 (step S23).
(36) The atom numbers c and h obtained in step S21 respectively correspond to the number C.sub.i of carbon atoms and the number H.sub.i of hydrogen atoms included in the molecular structure of the mixture component i, and the sum of the atom numbers f and cl corresponds to the atom number F.sub.i of halogen atoms included in the molecular structure of the mixture component i.
(37) The flammability evaluation index calculation unit 12 calculates the number d.sub.i of double bonds included in the molecular structure of the mixture component i, by using the number C.sub.i of carbon atoms, the number H.sub.i of hydrogen atoms, and the number F.sub.i of halogen atoms included in the molecular structure of the mixture component i that are determined in step S23 (step S25).
(38) The flammability evaluation index calculation unit 12 executes calculation of the following formula (5) by using C.sub.i, F.sub.i, and d.sub.i determined in steps S23 and S25 (step S27).
A.sub.m=A.sub.m+H.sub.i/H.sub.i+αF.sub.i−d.sub.iy.sub.i (5)
(39) A.sub.m on the right side of the formula (5) is the value of the flammability evaluation index calculated by iterative processing.
(40)
(41) For example, when the boundary value between the flammability class 1 and the flammability class 2 is set to A.sub.m=0.006, a case where a mixed refrigerant material classified into the flammability class 2 in the experiment has a calculated flammability evaluation index A.sub.m of a value smaller than 0.006 and is predicted as the flammability class 1 occurs 3 times.
(42) Since the number of classification errors is reduced, the time required for additional flammability experiments for verifying the prediction is reduced. The flammability evaluation using the flammability evaluation index A.sub.m calculated according to the processing procedure performed by the information processing apparatus of the first embodiment has higher accuracy than the comparative example.
(43) An information processing apparatus according to a second embodiment will be described. The information processing apparatus according to the second embodiment is an apparatus for determining the flammability class of an unknown mixed refrigerant material by calculating the flammability evaluation index A.sub.m.
(44) The storage unit 200 further stores, as input parameters 210, a threshold value T.sub.12 for distinguishing the flammability class 1 and the flammability class 2 from each other and a threshold value T.sub.23 for distinguishing the flammability class 2 and the flammability class 3 from each other with reference to the value of the flammability evaluation index A.sub.m, in addition to the input parameters 110 described with reference to
(45) The flammability classification unit 23 is, for example, a central processing unit (CPU).
(46) A flammability classification method performed by the information processing apparatus according to the second embodiment will be described.
(47) The mixed refrigerant flammability classification apparatus 20 obtains the flammability evaluation index A.sub.m for an unknown mixed refrigerant material, and is capable of determining the flammability class with high accuracy.
(48) All examples and conditional language provided herein are intended for the pedagogical purposes of aiding the reader in understanding the invention and the concepts contributed by the inventor to further the art, and are not to be construed as limitations to such specifically recited examples and conditions, nor does the organization of such examples in the specification relate to a showing of the superiority and inferiority of the invention. Although one or more embodiments of the present invention have been described in detail, it should be understood that the various changes, substitutions, and alterations could be made hereto without departing from the spirit and scope of the invention.