Se ha incluido el Hamiltoniano en la base de Chuang. Ademas los perfiles de las
[ptslat.git] / str_mod.f90
blobc7592dd96bb422e71868d661b3c65857a82110df
1 MODULE STRAIN_CALC
3 IMPLICIT NONE
5 CONTAINS
7 SUBROUTINE STRISO(EESUM,EEDIF,EEZZ,EERZ,CHI)
8 Use Input_Data
9 IMPLICIT NONE
10 REAL, INTENT(IN ) :: CHI
11 REAL, INTENT( OUT) :: EESUM,EEDIF,EEZZ,EERZ
13 DOUBLE PRECISION :: AASUM,AADIF,AARZ
15 !!! COMMON
16 REAL :: RHO,ZETA,ETA
17 COMMON /QAGON/RHO,ZETA,ETA
19 ETA=1.E0
20 CALL PREST(AASUM,AADIF,AARZ)
22 EESUM = - BIAUX*(AASUM+CHI)+BISUM*CHI
23 EEZZ = + BIAUX*(AASUM+CHI)+BIZZ*CHI
24 EEDIF = BIAUX*(AADIF-CHI)
25 EERZ = BIAUX*AARZ
27 END SUBROUTINE STRISO
29 SUBROUTINE STRANISO(EESUM,EEDIF,EEZZ,EERZ,CHI)
30 Use Input_Data
31 IMPLICIT NONE
32 REAL, INTENT(IN ) :: CHI
33 REAL, INTENT( OUT) :: EESUM,EEDIF,EEZZ,EERZ
35 DOUBLE PRECISION :: AASUM1,AADIF1,AARZ1,&
36 AASUM2,AADIF2,AARZ2
38 !!! COMMON
39 REAL :: RHO,ZETA,ETA
40 COMMON /QAGON/RHO,ZETA,ETA
42 ETA=ETA1
43 CALL PREST(AASUM1,AADIF1,AARZ1)
44 ETA=ETA2
45 CALL PREST(AASUM2,AADIF2,AARZ2)
47 EESUM = (2.E0*EPSA + CN1_2G)*CHI + &
48 (CN02_1*AASUM2 - CN02_2*AASUM1)/ETA_DIF
49 EEDIF = +CN1_2G*CHI - &
50 (CN02_1*AADIF2 - CN02_2*AADIF1)/ETA_DIF
51 EEZZ = EPSC*CHI + &
52 (CN42_1*AASUM2 - CN42_2*AASUM1)/ETA_DIF
53 EERZ = (CN31_1*AARZ2 - CN31_2*AARZ1)/ETA_DIF
55 ! WRITE(12,'(10(E15.8,1X))')ZETA,RHO,AASUM1,AASUM2,AADIF1,AADIF2
57 RETURN
59 END SUBROUTINE STRANISO
61 SUBROUTINE PREST(AASUM,AADIF,AARZ)
63 Use Input_Data, ONLY: RD,RC,ZC
65 IMPLICIT NONE
67 !! 'dummy' and local variables !!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!
69 DOUBLE PRECISION AASUM,AADIF,AARZ,RO,ZE
71 !! GAG Variables !!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!
73 INTEGER, PARAMETER :: LIMITE=100
74 DOUBLE PRECISION AL,AU,ABSERR,EPSABS,EPSREL,WORK(4*LIMITE)
75 INTEGER IER,IWORK(LIMITE),KEY,LAST,LENW,LIMIT,NEVAL
77 DOUBLE PRECISION, EXTERNAL :: I_FA00,I_FA10,I_FA20
79 !!! COMMON
80 REAL :: RHO,ZETA,ETA
81 COMMON /QAGON/RHO,ZETA,ETA
83 !!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!
85 RO=RHO
86 ZE=ZETA
87 AL=0.D0
88 AU=DBLE(RD)
90 EPSABS=0.D0
91 EPSREL=1.D-4
92 KEY=6
93 LIMIT=LIMITE
94 LENW=LIMIT*4
96 CALL DQAG(I_FA00,AL,AU,EPSABS,EPSREL,KEY,AASUM,ABSERR,NEVAL, &
97 IER,LIMIT,LENW,LAST,IWORK,WORK)
98 IF (IER.NE.0) &
99 CALL DQAG_CHECK("FA00","AASUM",AASUM,ABSERR,RO*RC,ZE*ZC,NEVAL,IER,LAST)
102 CALL DQAG(I_FA10,AL,AU,EPSABS,EPSREL,KEY,AARZ,ABSERR,NEVAL, &
103 IER,LIMIT,LENW,LAST,IWORK,WORK)
105 IF (IER.NE.0) &
106 CALL DQAG_CHECK("FA10","AARZ",AARZ,ABSERR,RO*RC,ZE*ZC,NEVAL,IER,LAST)
108 CALL DQAG(I_FA20,AL,AU,EPSABS,EPSREL,KEY,AADIF,ABSERR,NEVAL, &
109 IER,LIMIT,LENW,LAST,IWORK,WORK)
111 IF (IER.NE.0) &
112 CALL DQAG_CHECK("FA20","AADIF",AADIF,ABSERR,RO*RC,ZE*ZC,NEVAL,IER,LAST)
114 RETURN
115 END SUBROUTINE PREST
117 SUBROUTINE DQAG_CHECK(FUNC,RESNAME,RES,ABSERR,RO,ZE,NEVAL,IER,LAST)
118 IMPLICIT NONE
119 CHARACTER(LEN=*) :: FUNC,RESNAME
120 DOUBLE PRECISION :: RES,ABSERR,RO,ZE
121 INTEGER :: NEVAL,IER,LAST
122 WRITE(6,*)"ERROR AT: RHO: ",RO," ZETA: ",ZE
123 WRITE(6,*)"QAG ",TRIM(FUNC)," ",TRIM(RESNAME)," RESULT=",RES
124 WRITE(6,*)"QAG ABSERR=",ABSERR
125 WRITE(6,*)"QAG NEVAL=",NEVAL
126 WRITE(6,*)"QAG IER=",IER
127 WRITE(6,*)"QAG LAST=",LAST
129 RETURN
130 END SUBROUTINE DQAG_CHECK
132 FUNCTION FA00(RHO,ZETA,RHOP,ZM,ETA) RESULT(A00)
133 Use Input_Data, ONLY: RC,ZC
134 Use ELIPT_MOD
136 IMPLICIT NONE
137 DOUBLE PRECISION, INTENT(IN) :: RHO,ZETA,RHOP,ZM,ETA
138 DOUBLE PRECISION :: A00
140 DOUBLE PRECISION :: PI,DPI
141 DOUBLE PRECISION :: SRRHOP,RRHOP15,SM,S0,DELTAM,DELTA0,&
142 KM,K0,CKM,CK0,KKM,KK0,EKM,EK0
144 PI = DATAN(1.D0)*4.D0
145 DPI = 2.D0*PI
147 SRRHOP=SQRT(RHO*RHOP)
148 RRHOP15=SQRT(RHO*RHOP)**3
150 SM = DSIGN(1.D0,ZETA-ZM)
151 S0 = DSIGN(1.D0,ZETA)
153 DELTAM = DSQRT(ETA)*DABS(ZETA-ZM)*ZC/RC
154 DELTA0 = DSQRT(ETA)*DABS(ZETA)*ZC/RC
156 KM = 2.D0*DSQRT( RHO*RHOP/((RHO+RHOP)**2+DELTAM**2) )
157 K0 = 2.D0*DSQRT( RHO*RHOP/((RHO+RHOP)**2+DELTA0**2) )
159 CKM = (1.D0-KM**2)
160 CK0 = (1.D0-K0**2)
162 CALL ELIPT0(KM,KKM,EKM)
163 CALL ELIPT0(K0,KK0,EK0)
165 IF (RHO .EQ. 0.D0) THEN
166 A00 = ( SM*DELTAM/SQRT(RHOP**2+DELTAM**2)**3) &
167 -(S0*DELTA0/SQRT(RHOP**2+DELTA0**2)**3 )
168 A00 = A00/2.D0
169 RETURN
170 END IF
172 A00 = SM*DELTAM*KM**3/(2.D0*DPI*CKM*RRHOP15)*EKM &
173 -S0*DELTA0*K0**3/(2.D0*DPI*CK0*RRHOP15)*EK0
175 A00 = A00/2.D0
177 RETURN
180 END FUNCTION FA00
182 FUNCTION FA10(RHO,ZETA,RHOP,ZM,ETA) RESULT(A10)
183 Use Input_Data, ONLY: RC,ZC
184 Use ELIPT_MOD
186 IMPLICIT NONE
187 DOUBLE PRECISION, INTENT(IN) :: RHO,ZETA,RHOP,ZM,ETA
188 DOUBLE PRECISION :: A10
190 DOUBLE PRECISION :: PI,DPI
191 DOUBLE PRECISION :: SRRHOP,RRHOP15,SM,S0,DELTAM,DELTA0,&
192 KM,K0,CKM,CK0,KKM,KK0,EKM,EK0
194 PI = DATAN(1.D0)*4.D0
195 DPI = 2.D0*PI
197 SRRHOP=DSQRT(RHO*RHOP)
198 RRHOP15=DSQRT(RHO*RHOP)**3
200 SM = DSIGN(1.D0,ZETA-ZM)
201 S0 = DSIGN(1.D0,ZETA)
203 DELTAM = DSQRT(ETA)*DABS(ZETA-ZM)*ZC/RC
204 DELTA0 = DSQRT(ETA)*DABS(ZETA)*ZC/RC
206 KM = 2.D0*DSQRT( RHO*RHOP/((RHO+RHOP)**2+DELTAM**2) )
207 K0 = 2.D0*DSQRT( RHO*RHOP/((RHO+RHOP)**2+DELTA0**2) )
209 CKM = (1.D0-KM**2)
210 CK0 = (1.D0-K0**2)
212 CALL ELIPT0(KM,KKM,EKM)
213 CALL ELIPT0(K0,KK0,EK0)
215 IF (RHO .EQ. 0.D0) THEN
216 A10 = 0.D0
217 RETURN
218 END IF
220 A10 = KM/(4.D0*DPI*CKM*RHO*RRHOP15) &
221 * ( KM**2*(RHO**2-RHOP**2-DELTAM**2)*EKM &
222 + 4.D0*RHO*RHOP*CKM*KKM ) &
223 - K0/(4.D0*DPI*CK0*RHO*RRHOP15) &
224 * ( K0**2*(RHO**2-RHOP**2-DELTA0**2)*EK0 &
225 + 4.D0*RHO*RHOP*CK0*KK0 )
227 A10 = A10/2.D0
229 RETURN
231 END FUNCTION FA10
233 FUNCTION FA20(RHO,ZETA,RHOP,ZM,ETA) RESULT(A20)
234 Use Input_Data, ONLY: RC,ZC
235 Use ELIPT_MOD
237 IMPLICIT NONE
238 DOUBLE PRECISION, INTENT(IN) :: RHO,ZETA,RHOP,ZM,ETA
239 DOUBLE PRECISION :: A20
241 DOUBLE PRECISION :: PI,DPI
242 DOUBLE PRECISION :: SRRHOP,RRHOP15,SM,S0,DELTAM,DELTA0,&
243 KM,K0,CKM,CK0,KKM,KK0,EKM,EK0
245 DOUBLE PRECISION :: SIRHO, PSIM, PSI0
247 PI = DATAN(1.D0)*4.D0
248 DPI = 2.D0*PI
250 SRRHOP=DSQRT(RHO*RHOP)
251 RRHOP15=DSQRT(RHO*RHOP)**3
253 SM = DSIGN(1.D0,ZETA-ZM)
254 S0 = DSIGN(1.D0,ZETA)
256 DELTAM = DSQRT(ETA)*DABS(ZETA-ZM)*ZC/RC
257 DELTA0 = DSQRT(ETA)*DABS(ZETA)*ZC/RC
259 SIRHO = DSIGN(1.D0,RHO-RHOP)
261 KM = 2.D0*DSQRT( RHO*RHOP/((RHO+RHOP)**2+DELTAM**2) )
262 K0 = 2.D0*DSQRT( RHO*RHOP/((RHO+RHOP)**2+DELTA0**2) )
264 CKM = (1.D0-KM**2)
265 CK0 = (1.D0-K0**2)
267 CALL ELIPT0(KM,KKM,EKM)
268 CALL ELIPT0(K0,KK0,EK0)
270 PSIM = DASIN( DELTAM/DSQRT((RHO-RHOP)**2+DELTAM**2) )
271 PSI0 = DASIN( DELTA0/DSQRT((RHO-RHOP)**2+DELTA0**2) )
274 IF (RHO .EQ. 0.D0) THEN
275 A20 = 0.D0
276 RETURN
277 END IF
279 A20 = SM*( -DELTAM*KM**3/(4.D0*PI*CKM*RRHOP15) * EKM &
280 -( DELTAM*KM/(PI*SRRHOP)*KKM &
281 + SIRHO*LAMBDA0(PSIM,KM) )/RHO**2 ) &
282 - S0*( -DELTA0*K0**3/(4.D0*PI*CK0*RRHOP15) * EK0 &
283 -( DELTA0*K0/(PI*SRRHOP)*KK0 &
284 + SIRHO*LAMBDA0(PSI0,K0) )/RHO**2 )
286 A20 = A20/2.D0
288 RETURN
290 END FUNCTION FA20
292 END MODULE STRAIN_CALC