Fix #4414: Add url for bug reporting page in bug_report
[maxima.git] / share / hompack / fortran / fixpqs.f
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1 SUBROUTINE FIXPQS(N,Y,IFLAG,ARCRE,ARCAE,ANSRE,ANSAE,TRACE,
2 & A,NFE,ARCLEN,YP,YOLD,YPOLD,QR,LENQR,PIVOT,PP,RHOVEC,Z0,DZ,
3 & T,WORK,SSPAR,PAR,IPAR)
5 C SUBROUTINE FIXPQS FINDS A FIXED POINT OR ZERO OF THE
6 C N-DIMENSIONAL VECTOR FUNCTION F(X), OR TRACKS A ZERO CURVE OF A
7 C GENERAL HOMOTOPY MAP RHO(A,X,LAMBDA). FOR THE FIXED POINT PROBLEM
8 C F(X) IS ASSUMED TO BE A C2 MAP OF SOME BALL INTO ITSELF. THE
9 C EQUATION X=F(X) IS SOLVED BY FOLLOWING THE ZERO CURVE OF THE
10 C HOMOTOPY MAP
12 C LAMBDA*(X - F(X)) + (1 - LAMBDA)*(X - A),
14 C STARTING FROM LAMBDA = 0, X = A. THE CURVE IS PARAMETERIZED
15 C BY ARC LENGTH S, AND IS FOLLOWED BY SOLVING THE ORDINARY
16 C DIFFERENTIAL EQUATION D(HOMOTOPY MAP)/DS = 0 FOR
17 C Y(S) = (X(S),LAMBDA(S)). THIS IS DONE BY USING A HERMITE CUBIC
18 C PREDICTOR AND A CORRECTOR WHICH RETURNS TO THE ZERO CURVE IN A
19 C HYPERPLANE PERPENDICULAR TO THE TANGENT TO THE ZERO CURVE AT THE
20 C MOST RECENT POINT.
22 C FOR THE ZERO FINDING PROBLEM F(X) IS ASSUMED TO BE A C2 MAP SUCH
23 C THAT FOR SOME R > 0, X*F(X) >= 0 WHENEVER NORM(X) = R.
24 C THE EQUATION F(X) = 0 IS SOLVED BY FOLLOWING THE ZERO CURVE OF
25 C THE HOMOTOPY MAP
27 C LAMBDA*F(X) + (1 - LAMBDA)*(X - A)
29 C EMANATING FROM LAMBDA = 0, X = A.
31 C A MUST BE AN INTERIOR POINT OF THE ABOVE MENTIONED BALLS.
33 C FOR THE CURVE TRACKING PROBLEM RHO(A,X,LAMBDA) IS ASSUMED TO
34 C BE A C2 MAP FROM E**M X [0,1) X E**N INTO E**N, WHICH FOR
35 C ALMOST ALL PARAMETER VECTORS A IN SOME NONEMPTY OPEN SUBSET
36 C OF E**M SATISFIES
38 C RANK [D RHO(A,X,LAMBDA)/D LAMBDA, D RHO(A,X,LAMBDA)/DX] = N
40 C FOR ALL POINTS (X,LAMBDA) SUCH THAT RHO(A,X,LAMBDA) = 0. IT IS
41 C FURTHER ASSUMED THAT
43 C RANK [ D RHO(A,X0,0)/DX ] = N.
45 C WITH A FIXED, THE ZERO CURVE OF RHO(A,X,LAMBDA) EMANATING FROM
46 C LAMBDA = 0, X = X0 IS TRACKED UNTIL LAMBDA = 1 BY SOLVING THE
47 C ORDINARY DIFFERENTIAL EQUATION D RHO(A,X(S),LAMBDA(S))/DS = 0
48 C FOR Y(S) = (X(S),LAMBDA(S)), WHERE S IS ARC LENGTH ALONG THE
49 C ZERO CURVE. ALSO THE HOMOTOPY MAP RHO(A,X,LAMBDA) IS ASSUMED TO
50 C BE CONSTRUCTED SUCH THAT
52 C D LAMBDA(0)/DS > 0.
54 C FOR THE FIXED POINT AND ZERO FINDING PROBLEMS, THE USER MUST SUPPLY
55 C A SUBROUTINE F(X,V) WHICH EVALUATES F(X) AT X AND RETURNS THE
56 C VECTOR F(X) IN V, AND A SUBROUTINE FJACS(X,QR,LENQR,PIVOT) WHICH
57 C EVALUATES THE (SYMMETRIC) JACOBIAN MATRIX OF F(X) AT X, AND RETURNS
58 C THE SYMMETRIC JACOBIAN MATRIX IN PACKED SKYLINE STORAGE FORMAT IN QR.
59 C LENQR AND PIVOT DESCRIBE THE DATA STRUCTURE IN QR. FOR THE CURVE
60 C TRACKING PROBLEM, THE USER MUST SUPPLY A SUBROUTINE
61 C RHO(A,LAMBDA,X,V,PAR,IPAR) WHICH EVALUATES THE HOMOTOPY MAP RHO
62 C AT (A,X,LAMBDA) AND RETURNS THE VECTOR RHO(A,X,LAMBDA) IN V,
63 C AND A SUBROUTINE RHOJS(A,LAMBDA,X,QR,LENQR,PIVOT,PP,PAR,IPAR) WHICH
64 C RETURNS IN QR THE SYMMETRIC N X N JACOBIAN MATRIX [D RHO/DX]
65 C EVALUATED AT (A,X,LAMBDA) AND STORED IN PACKED SKYLINE FORMAT,
66 C AND RETURNS IN PP THE VECTOR -(D RHO/D LAMBDA) EVALUATED AT
67 C (A,X,LAMBDA). LENQR AND PIVOT DESCRIBE THE DATA STRUCTURE IN
68 C QR.
69 C *** NOTE THE MINUS SIGN IN THE DEFINITION OF PP. ***
72 C FIXPQS DIRECTLY OR INDIRECTLY USES THE SUBROUTINES D1MACH, F
73 C (OR RHO), FJACS (OR RHOJS), GMFADS, MULTDS, PCGQS, ROOTQS, STEPQS,
74 C SOLVDS, AND THE BLAS ROUTINES DAXPY, DCOPY, DDOT, DNRM2, AND DSCAL.
75 C ONLY D1MACH CONTAINS MACHINE DEPENDENT CONSTANTS. NO OTHER
76 C MODIFICATIONS BY THE USER ARE REQUIRED.
79 C ON INPUT:
81 C N IS THE DIMENSION OF X, F(X), AND RHO(A,X,LAMBDA).
83 C Y(1:N+1) CONTAINS THE STARTING POINT FOR TRACKING THE HOMOTOPY MAP.
84 C (Y(1),...,Y(N)) = A FOR THE FIXED POINT AND ZERO FINDING
85 C PROBLEMS. (Y(1),...,Y(N)) = X0 FOR THE CURVE TRACKING PROBLEM.
86 C Y(N+1) NEED NOT BE DEFINED BY THE USER.
88 C IFLAG CAN BE -2, -1, 0, 2, OR 3. IFLAG SHOULD BE 0 ON THE FIRST
89 C CALL TO FIXPQS FOR THE PROBLEM X=F(X), -1 FOR THE PROBLEM
90 C F(X)=0, AND -2 FOR THE PROBLEM RHO(A,X,LAMBDA)=0. IN CERTAIN
91 C SITUATIONS IFLAG IS SET TO 2 OR 3 BY FIXPQS, AND FIXPQS CAN
92 C BE CALLED AGAIN WITHOUT CHANGING IFLAG.
94 C ARCRE, ARCAE ARE THE RELATIVE AND ABSOLUTE ERRORS, RESPECTIVELY,
95 C ALLOWED THE ITERATION ALONG THE ZERO CURVE. IF
96 C ARC?E .LE. 0.0 ON INPUT, IT IS RESET TO .5*SQRT(ANS?E).
97 C NORMALLY ARC?E SHOULD BE CONSIDERABLY LARGER THAN ANS?E.
99 C ANSRE, ANSAE ARE THE RELATIVE AND ABSOLUTE ERROR VALUES USED FOR
100 C THE ANSWER AT LAMBDA = 1. THE ACCEPTED ANSWER Y = (X,LAMBDA)
101 C SATISFIES
103 C |Y(1) - 1| .LE. ANSRE + ANSAE .AND.
105 C ||DZ|| .LE. ANSRE*||Y|| + ANSAE WHERE
107 C DZ IS THE NEWTON STEP TO Y.
109 C TRACE IS AN INTEGER SPECIFYING THE LOGICAL I/O UNIT FOR
110 C INTERMEDIATE OUTPUT. IF TRACE .GT. 0 THE POINTS COMPUTED ON
111 C THE ZERO CURVE ARE WRITTEN TO I/O UNIT TRACE .
113 C A(1:*) CONTAINS THE PARAMETER VECTOR A. FOR THE FIXED POINT
114 C AND ZERO FINDING PROBLEMS, A NEED NOT BE INITIALIZED BY THE
115 C USER, AND IS ASSUMED TO HAVE LENGTH N. FOR THE CURVE
116 C TRACKING PROBLEM, A MUST BE INITIALIZED BY THE USER.
118 C YP(1:N+1) IS A WORK ARRAY CONTAINING THE TANGENT VECTOR TO THE
119 C ZERO CURVE AT THE CURRENT POINT Y.
121 C YOLD(1:N+1) IS A WORK ARRAY CONTAINING THE PREVIOUS POINT FOUND
122 C ON THE ZERO CURVE.
124 C YPOLD(1:N+1) IS A WORK ARRAY CONTAINING THE TANGENT VECTOR TO
125 C THE ZERO CURVE AT YOLD.
127 C QR(1:LENQR) IS A WORK ARRAY CONTAINING THE N X N SYMMETRIC
128 C JACOBIAN MATRIX WITH RESPECT TO X STORED IN PACKED SKYLINE
129 C STORAGE FORMAT. LENQR AND PIVOT DESCRIBE THE DATA
130 C STRUCTURE IN QR. (SEE SUBROUTINE PCGQS FOR A DESCRIPTION
131 C OF THIS DATA STRUCTURE).
133 C LENQR IS THE LENGTH OF THE N-DIMENSIONAL ARRAY QR. I.E.
134 C IT IS THE NUMBER OF NON-ZERO ENTRIES IN THE JACOBIAN
135 C MATRIX [DF/DX] (OR [D RHO/DX]).
137 C PIVOT(1:N+2) IS A WORK ARRAY WHOSE FIRST N+1 COMPONENTS CONTAIN
138 C THE INDICES OF THE DIAGONAL ELEMENTS OF THE N X N SYMMETRIC
139 C JACOBIAN MATRIX (WITH RESPECT TO X) WITHIN QR.
141 C PP(1:N) IS A WORK ARRAY CONTAINING THE NEGATIVE OF THE LAST COLUMN
142 C OF THE JACOBIAN MATRIX -[D RHO/D LAMBDA].
144 C RHOVEC(1:N+1), Z0(1:N+1), DZ(1:N+1), T(1:N+1) ARE ALL WORK ARRAYS
145 C USED BY STEPQS, TANGQS, AND ROOTQS TO CALCULATE THE TANGENT
146 C VECTORS AND NEWTON STEPS.
148 C WORK(1:8*(N+1)+LENQR) IS A WORK ARRAY USED BY THE CONJUGATE GRADIENT
149 C ALGORITHM TO SOLVE LINEAR SYSTEMS.
151 C SSPAR(1:4) = (HMIN, HMAX, BMIN, BMAX) IS A VECTOR OF PARAMETERS
152 C USED FOR THE OPTIMAL STEP SIZE ESTIMATION. A DEFAULT VALUE
153 C CAN BE SPECIFIED FOR ANY OF THESE FOUR PARAMETERS BY SETTING IT
154 C .LE. 0.0 ON INPUT. SEE THE COMMENTS IN STEPQS FOR MORE
155 C INFORMATION ABOUT THESE PARAMETERS.
157 C PAR(1:*) AND IPAR(1:*) ARE ARRAYS FOR (OPTIONAL) USER PARAMETERS,
158 C WHICH ARE SIMPLY PASSED THROUGH TO THE USER WRITTEN SUBROUTINES
159 C RHO, RHOJS.
162 C ON OUTPUT:
164 C N , TRACE , A , LENQR ARE UNCHANGED.
166 C Y(N+1) = LAMBDA, (Y(1),...,Y(N)) = X, AND Y IS AN APPROXIMATE
167 C ZERO OF THE HOMOTOPY MAP. NORMALLY LAMBDA = 1 AND X IS A
168 C FIXED POINT OR ZERO OF F(X). IN ABNORMAL SITUATIONS, LAMBDA
169 C MAY ONLY BE NEAR 1 AND X NEAR A FIXED POINT OR ZERO.
171 C IFLAG =
173 C 1 NORMAL RETURN.
175 C 2 SPECIFIED ERROR TOLERANCE CANNOT BE MET. SOME OR ALL OF
176 C ARCRE, ARCAE, ANSRE, ANSAE HAVE BEEN INCREASED TO
177 C SUITABLE VALUES. TO CONTINUE, JUST CALL FIXPQS AGAIN
178 C WITHOUT CHANGING ANY PARAMETERS.
180 C 3 STEPQS HAS BEEN CALLED 1000 TIMES. TO CONTINUE, CALL
181 C FIXPQS AGAIN WITHOUT CHANGING ANY PARAMETERS.
183 C 4 JACOBIAN MATRIX DOES NOT HAVE FULL RANK. THE ALGORITHM
184 C HAS FAILED (THE ZERO CURVE OF THE HOMOTOPY MAP CANNOT BE
185 C FOLLOWED ANY FURTHER).
187 C 5 THE TRACKING ALGORITHM HAS LOST THE ZERO CURVE OF THE
188 C HOMOTOPY MAP AND IS NOT MAKING PROGRESS. THE ERROR
189 C TOLERANCES ARC?E AND ANS?E WERE TOO LENIENT. THE PROBLEM
190 C SHOULD BE RESTRARTED BY CALLING FIXPQS WITH SMALLER ERROR
191 C TOLERANCES AND IFLAG = 0 (-1, -2).
193 C 6 THE NEWTON ITERATION IN STEPQS OR ROOTQS FAILED TO
194 C CONVERGE. THE ERROR TOLERANCES ANS?E MAY BE TOO STRINGENT.
196 C 7 ILLEGAL INPUT PARAMETERS, A FATAL ERROR.
198 C ARCRE, ARCAE, ANSRE, ANSAE ARE UNCHANGED AFTER A NORMAL RETURN
199 C (IFLAG = 1). THEY ARE INCREASED TO APPROPRIATE VALUES ON THE
200 C RETURN IFLAG = 2.
202 C NFE IS THE NUMBER OF JACOBIAN EVALUATIONS.
204 C ARCLEN IS THE APPROXIMATE LENGTH OF THE ZERO CURVE.
206 C ***** DECLARATIONS *****
208 C FUNCTION DECLARATIONS
210 DOUBLE PRECISION D1MACH, DNRM2
212 C LOCAL VARIABLES
214 DOUBLE PRECISION ABSERR, H, HOLD, RELERR, S, WK
215 INTEGER IFLAGC, ITER, JW, LIMITD, LIMIT, NP1, PCGWK
216 LOGICAL CRASH, START
218 C SCALAR ARGUMENTS
220 DOUBLE PRECISION ARCRE, ARCAE, ANSRE, ANSAE, ARCLEN
221 INTEGER N, IFLAG, TRACE, NFE, LENQR
223 C ARRAY DECLARATIONS
225 DOUBLE PRECISION A(N), Y(N+1), YP(N+1), YOLD(N+1), YPOLD(N+1),
226 & QR(LENQR), PP(N), RHOVEC(N+1), Z0(N+1), DZ(N+1), T(N+1),
227 & WORK(8*(N+1)+LENQR), SSPAR(4), PAR(1)
228 INTEGER PIVOT(N+2), IPAR(1)
230 SAVE
232 C ***** END OF DECLARATIONS *****
234 C LIMITD IS AN UPPER BOUND ON THE NUMBER OF STEPS. IT MAY BE
235 C CHANGED BY CHANGING THE FOLLOWING PARAMETER STATEMENT:
236 PARAMETER (LIMITD =1000)
238 C ***** FIRST EXECUTABLE STATEMENT *****
240 C CHECK IFLAG
242 IF (N .LE. 0 .OR. ANSRE .LE. 0.0 .OR. ANSAE .LT. 0.0)
243 & IFLAG = 7
244 IF (IFLAG .GE. -2 .AND. IFLAG .LE. 0) GO TO 10
245 IF (IFLAG .EQ. 2) GO TO 50
246 IF (IFLAG .EQ. 3) GO TO 40
248 C ONLY VALID INPUT FOR IFLAG IS -2, -1, 0, 2, 3.
250 IFLAG = 7
251 RETURN
253 C ***** INITIALIZATION BLOCK *****
255 10 ARCLEN = 0.0
256 IF (ARCRE .LE. 0.0) ARCRE = .5*SQRT(ANSRE)
257 IF (ARCAE .LE. 0.0) ARCAE = .5*SQRT(ANSAE)
258 NFE=0
259 IFLAGC = IFLAG
260 NP1=N+1
261 PCGWK = 2*N+3
263 C SET INITIAL CONDITIONS FOR FIRST CALL TO STEPQS.
265 START=.TRUE.
266 CRASH=.FALSE.
267 RELERR = ARCRE
268 ABSERR = ARCAE
269 HOLD=1.0
270 H=0.1
271 S=0.0
272 YPOLD(NP1) = 1.0
273 Y(NP1) = 0.0
274 DO 20 JW=1,N
275 YPOLD(JW)=0.0
276 20 CONTINUE
278 C SET OPTIMAL STEP SIZE ESTIMATION PARAMETERS.
280 C MINIMUM STEP SIZE HMIN
281 IF (SSPAR(1) .LE. 0.0) SSPAR(1)= (SQRT(N+1.0)+4.0)*D1MACH(4)
282 C MAXIMUM STEP SIZE HMAX
283 IF (SSPAR(2) .LE. 0.0) SSPAR(2)= 1.0
284 C MINIMUM STEP REDUCTION FACTOR BMIN
285 IF (SSPAR(3) .LE. 0.0) SSPAR(3)= 0.1
286 C MAXIMUM STEP EXPANSION FACTOR BMAX
287 IF (SSPAR(4) .LE. 0.0) SSPAR(4)= 7.0
289 C LOAD A FOR THE FIXED POINT AND ZERO FINDING PROBLEMS.
291 IF (IFLAGC .GE. -1) THEN
292 CALL DCOPY(N,Y,1,A,1)
293 ENDIF
295 40 LIMIT=LIMITD
297 C ***** END OF INITIALIZATION BLOCK. *****
299 C ***** MAIN LOOP. *****
301 50 DO 400 ITER=1,LIMIT
302 IF (Y(NP1) .LT. 0.0) THEN
303 ARCLEN = S
304 IFLAG = 5
305 RETURN
306 END IF
308 C TAKE A STEP ALONG THE CURVE.
310 CALL STEPQS(N,NFE,IFLAGC,LENQR,START,CRASH,HOLD,H,WK,RELERR,
311 & ABSERR,S,Y,YP,YOLD,YPOLD,A,QR,PIVOT,PP,RHOVEC,Z0,DZ,T,
312 & WORK,SSPAR,PAR,IPAR)
314 C PRINT LATEST POINT ON CURVE IF REQUESTED.
316 IF (TRACE .GT. 0) THEN
317 WRITE (TRACE,217) ITER,NFE,S,Y(NP1),(Y(JW),JW=1,N)
318 217 FORMAT(/' STEP',I5,3X,'NFE =',I5,3X,'ARC LENGTH =',F9.4,3X,
319 & 'LAMBDA =',F7.4,5X,'X vector:'/1P,(1X,6E12.4))
320 ENDIF
322 C CHECK IF THE STEP WAS SUCCESSFUL.
324 IF (IFLAGC .GT. 0) THEN
325 ARCLEN=S
326 IFLAG=IFLAGC
327 RETURN
328 END IF
330 IF (CRASH) THEN
332 C RETURN CODE FOR ERROR TOLERANCE TOO SMALL.
334 IFLAG=2
336 C CHANGE ERROR TOLERANCES.
338 IF (ARCRE .LT. RELERR) THEN
339 ARCRE=RELERR
340 ANSRE=RELERR
341 ENDIF
342 IF (ARCAE .LT. ABSERR) ARCAE=ABSERR
344 C CHANGE LIMIT ON NUMBER OF ITERATIONS.
346 LIMIT = LIMIT - ITER
347 RETURN
348 END IF
350 C IF LAMBDA >= 1.0, USE ROOTQS TO FIND SOLUTION.
352 IF (Y(NP1) .GE. 1.0) GOTO 500
354 400 CONTINUE
356 C ***** END OF MAIN LOOP *****
358 C DID NOT CONVERGE IN LIMIT ITERATIONS, SET IFLAG AND RETURN.
360 ARCLEN = S
361 IFLAG = 3
362 RETURN
364 C ***** FINAL STEP -- FIND SOLUTION AT LAMBDA=1 *****
366 C SAVE YOLD FOR ARC LENGTH CALCULATION LATER.
368 500 CALL DCOPY(NP1,YOLD,1,T,1)
370 C FIND SOLUTION.
372 CALL ROOTQS(N,NFE,IFLAGC,LENQR,ANSRE,ANSAE,Y,YP,YOLD,YPOLD,
373 & A,QR,PIVOT,PP,RHOVEC,Z0,DZ,WORK(PCGWK),PAR,IPAR)
375 C CHECK IF SOLUTION WAS FOUND AND SET IFLAG ACCORDINGLY.
377 IFLAG=1
379 C SET ERROR FLAG IF ROOTQS COULD NOT GET THE POINT ON THE ZERO
380 C CURVE AT LAMBDA = 1.0 .
382 IF (IFLAGC .GT. 0) IFLAG=IFLAGC
384 C CALCULATE FINAL ARC LENGTH.
386 CALL DCOPY(NP1,Y,1,DZ,1)
387 WK=-1.0
388 CALL DAXPY(NP1,WK,T,1,DZ,1)
389 ARCLEN=S - HOLD + DNRM2(NP1,DZ,1)
391 C ***** END OF FINAL STEP *****
393 RETURN
395 C ***** END OF SUBROUTINE FIXPQS *****