Resumindo:

Desenvolvi os perfis de concentrações. Tentei achar os valores de K em anexo no documento

Excel.
E, depois, tentei gerar o gráfico em um site -.
(https://www.desmos.com/calculator/ww9t45pvtk?lang=pt-BR) que tá nas imagens abaixo
como ficou.

dA
=−( K 1+ K 2 ) . A ( t )
dt
dP
=K 2 . A ( t )−K 3 . P ( t )
dt
dG
=K 1 . A ( t )+ K 3 . P ( t )
dt

1ª EDO:

dA
=−( K 1+ K 2 ) .dt
A
ln ( A )−C=(−K 1 + K 2 ) . t

ln ( A )=−( K 1 + K 2 ) . t+C
−( K 1 +K 2) .t
A ( t )=C . e
t=0 , A ( 0 )=130,43
−( K 1+ K 2 ). t
A ( t )=130,43. e
t = 30s
−30 ( K 1+ K 2 )
118,66=130,43.e

K=
ln ( 118,66
130,43 )
−30
K= K 1+ K 2=0,00315248
2ª EDO Por operadores diferenciais:

dP
=K 2 . A ( t )−K 3 . P ( t )
dt

D . P=K 2 . A ( t )−K 3 . P ( t )

D . P+ K 3 . P=K 2 . A

P ( D+ K 3 )=K 2 . A (eq 1)

D . P ( D+ K 3 ) =K 2 D . A

D . P ( D+ K 3 ) =−K 2 ( K 1+ K 2 ) . A

( D+ K 3 )
D.P =−K 2 . A (eq 2)
( K1+ K2)

( D+ K 3 )
D.P + P ( D+ K 3 ) =0
( K1+ K2)

P D.
( ( D+ K 3 )
( K 1+ K 2 ) )
+ ( D+ K 3 ) =0

P
(( ( D
K 1+ K 2 ) ) )
+1 ( D+ K 3 ) =0

D+ K 3=0

D=−K 3
 D
+1=0
( K 1+ K 2 )
D=−( K 1+ K 2 )
−K 3 .t − ( K 1 +K 2) t
P ( t ) =C0 . e +C 1 . e

0=C0. 1+C 1. 1

C 0=−C 1

P ( t ) =C1 ( e )
− ( K 1 +K 2) t −K 3 .t
−e

Derivando P(t):

dP
=C 1 (− ( K 1+ K 2 ) e ( + K3)
− K + K )t 1 2

dt
Isso será igual à equação original:

dP
=K 2 . A ( t )−K 3 . P ( t )=C 1 (−( K 1 + K 2 ) e−( K + K ) t + K 3 e−K 1 2 3 .t
)
dt

K 2 .(130,43. e
−( K 1+ K 2 ). t
)−K 3 .C 1 ( e
− ( K 1 +K 2) t
−e
−K 3 .t
) =C 1 (−( K 1+ K 2 ) e−( K + K )t + K 3 e−K . t )
1 2 3

K 2 .( C 0. e )=C 1 (−( K 1 + K 2 ) e−( K +K ) t + K 3 e− K .t ) + K 3 . C1 ( e−( K +K ) t −e−K .t )

− ( K 1 +K 2) .t 1 2 3 1 2 3

K2 .(C0. e )
− ( K 1 +K 2) .t

=C 1
(− ( K 1 + K 2) e − ( K 1 + K 2) t
+ K3 e
−K 3 . t
)+ K 3 . ( e−( K + K ) t −e− K .t )
1 2 3

C0. K2
=C 1
K 3− ( K 1 + K 2 )

Então:

C0 . K 2
.(e )
− ( K 1 + K 2) t − K 3 .t
P (t )= −e
K 3 −( K 1 + K 2 )
 −( K 1+ K 2 ). t
A ( t )=130,43. e

P ( t ) =C1 ( e )
− ( K 1 +K 2) t −K 3 .t
−e

dG
=K 1 . A ( t )+ K 3 . P ( t )
dt

G ( t ) −G0=∫ K 1 . A ( t ) + K 3 . P ( t ) dt

G ( t ) −G0=∫ K 1 .130,43. e + K 3 .C 1 ( e ) dt
− ( K 1 +K 2) .t − ( K 1+ K 2 ) t −K 3 . t
−e

( )
−( K 1+ K 2 ). t −( K 1+ K 2 ) t − K 3 .t
e e e
G ( t ) =K 1 . C 0 . + K 3 . C1 − +G0
−( K 1 + K 2 ) −( K 1 + K 2 ) −K 3

Como a concentração final será C0:

e (
( )
)
e ( )
− K 1+ K 2 .t − K 1+ K 2 t
e− K .t 3

lim K 1 .C 0 . + K3. C1 − +G0=G 0

n→∞ −( K 1 + K 2 ) −( K 1+ K 2) −K 3

G0=C 0

e (
( )
)
e ( )
− K 1+ K 2 . t − K 1+ K 2 t
e− K .t 3

G ( t ) =K 1 . C 0 . + K 3 . C1 − +C 0
−( K 1 + K 2 ) −( K 1 + K 2 ) −K 3

O modelo de G(t) pode ser operado para ficar com uma forma mais natural:

( )
−( K 1+ K 2 ). t − ( K 1+ K 2 ) t − K 3 .t
e e e
G ( t ) =K 1 . C 0 . + K 3 . C1 − +C 0
−( K 1 + K 2 ) −( K 1 + K 2 ) −K 3

( )
−( K + K ). t − ( K +K ) t
e 1 2
C0. K2 e e
−K . t 1 2 3

G ( t ) =K 1 . C 0 . + K 3. − +C 0
−( K 1 + K 2 ) K 3−( K 1 + K 2 ) −( K 1 + K 2 ) −K 3

( ( K1 e (
) )
−( K + K )t − K 1+ K 2 ) .t
K2 K3 e
− K .t
e 3 1 2

G ( t ) =C0 1+ − −
K 3− ( K 1+ K 2 ) K 3 K 1+ K2 K1+ K2

Colocando -e-(k1+k2)t /(k1+k2)em evidência:

 ( K 2 e−K . t
( ))
−( K + K ). t
e
3
K2 K3 1 2

G ( t ) =C0 1+ − K1+
K 3−K 1−K 2 K 1 + K 2 K 3−K 1−K 2

− ( K 1 +K 2) .t
A ( t )=C 0 . e
C0 . K 2
.(e )
− ( K 1 + K 2) t − K 3 .t
P (t )= −e
K 3 −( K 1 + K 2 )

( K 2 e−K . t e (
( ))
− K + K ). t
3
K2 K3 1 2

G ( t ) =C0 1+ − K1+
K 3−K 1−K 2 K 1 + K 2 K 3−K 1−K 2

Manipulações para obter K1+K2, e K3 no excel

K2
. ( A (t)−C 0 e )
−K 3 .t
P (t)=
K 3 −( K 1 + K 2 )

K2
. ( A ( a )−C 0 e )
−K 3 . a
P ( a) =
K 3 − ( K 1+ K 2 )

K2
. ( A (b)−C 0 e )
−K 3 . b
P(b)=
K 3 −( K 1 + K 2 )

P ( a) ( e )
− ( K 1+ K 2 ) .a −K 3. a
−e
= −( K + K ) .b −K . b
P (b ) ( e −e 1
) 2 3

P ( a) ( e )
− ( K 1+ K 2 ) .b
−e−K 3 .b
=( e )
− ( K 1+ K 2 ) .a −K 3 . a
−e
P (b)

P ( a) ( e ( )
( )
− K 1+ K 2 ) .b
− ( K 1+ K 2 ) .a −K 3 . b P ( a )−P ( b )
−e =e
P (b ) P ( b)
 P ( a)( e ) −P ( b ) e−( K + K ) .a
− ( K 1+ K 2 ) .b 1 2
− K 3 .b
=e
P ( a ) −P ( b )

( P (a )(e ) −P ( b ) e−( K + K ). a
)
− ( K 1+ K 2 ) .b 1 2

ln
P ( a )−P ( b )
K 3=
−b

K2
P(b)= . ( A (b)−C 0 e−K . b ) 3

K 3 −( K 1 + K 2 )

P ( b ) . ( K 3− ( K 1 + K 2 ) )
K 2=
( A ( b )−C 0 e−K . b ) 3

https://www.desmos.com/calculator/jtbr9uxvwk

https://colab.research.google.com/drive/1bUMPnoEtuQKqmVCRzvNsNwGx3RBXJS5H?
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Mínimos quadrados

Função de custo J:

J ( K 1 , K 2 , K 3 )=∑ ( A ( t ) −A i (t ) ) + ( P ( t )−Pi ( t ) ) + ( G ( t )−Gi ( t ))

2 2 2

J ( K 1 , K 2 , K 3 )=∑ ( A− A i) + ( P−Pi ) + ( G−Gi )

2 2 2

Removendo os (t) para simplificar a escrita, e realizando os quadrados:

J ( K 1 , K 2 , K 3 )=∑ ( A2− A . Ai + Ai2 ) + ( P2−P . Pi + Pi2 ) + ( G 2−G .Gi +Gi2 )

Agora vem a parte complicada, que são as derivadas parciais de J:

( ∂∂KJ , ∂∂KJ , ∂∂KJ )=( 0,0,0)

1 2 3

∂J
∂K1 [
=∑ 2 ( A− A i)
∂A
∂ K1
+ ( P−Pi )
∂P
∂ K1
+ ( G−Gi )
∂G
∂ K1 ]
∂J
∂K1 [
=∑ 2 ( A− A i)
∂A
∂ K1
+ ( P−Pi )
∂P
∂ K1
+ ( G−Gi )
∂G
∂ K1 ]
∂A
=−t . A
∂K1

∂P C0. K2 C0. K2
= . ( e
− ( K +K ) t1
−e− K .t
2
) + 3
. (−t . e (
− K +K )t
) 1 2

∂ K 1 [ K −( K + K ) ]
3 1 2
2
K 3− ( K 1 + K 2 )
 (
− ( K 1+ K 2 ) .t − ( K 1+ K 2 ) .t

( ) (
∂G K 2 e−K .t
3
−t . e ( K 1 + K 2 ) −e K2 K3 e (
− K + K ) .t
1 2
K2 K 3
=C 0 − K1+ − 1+
∂K1 ( K 3−K 1−K 2 )
2
( K1+ K2)
2
K 3−K 1−K 2 K1+ K2 ( K 3−K 1−

Dados usados: