Date: 2024-09-25T09:33:13+00:00

Actual source code: dvdutils.c
slepc-3.21.2 2024-09-25
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      1: /*
      2:    - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - -
      3:    SLEPc - Scalable Library for Eigenvalue Problem Computations
      4:    Copyright (c) 2002-, Universitat Politecnica de Valencia, Spain

      6:    This file is part of SLEPc.
      7:    SLEPc is distributed under a 2-clause BSD license (see LICENSE).
      8:    - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - -
      9: */
     10: /*
     11:    SLEPc eigensolver: "davidson"

     13:    Some utils
     14: */

     16: #include "davidson.h"

     18: typedef struct {
     19:   PC pc;
     20: } dvdPCWrapper;

     22: /*
     23:   Configure the harmonics.
     24:   switch (mode) {
     25:   DVD_HARM_RR:    harmonic RR
     26:   DVD_HARM_RRR:   relative harmonic RR
     27:   DVD_HARM_REIGS: rightmost eigenvalues
     28:   DVD_HARM_LEIGS: largest eigenvalues
     29:   }
     30:   fixedTarged, if true use the target instead of the best eigenvalue
     31:   target, the fixed target to be used
     32: */
     33: typedef struct {
     34:   PetscScalar Wa,Wb;       /* span{W} = span{Wa*AV - Wb*BV} */
     35:   PetscScalar Pa,Pb;       /* H=W'*(Pa*AV - Pb*BV), G=W'*(Wa*AV - Wb*BV) */
     36:   PetscBool   withTarget;
     37:   HarmType_t  mode;
     38: } dvdHarmonic;

     40: typedef struct {
     41:   Vec diagA, diagB;
     42: } dvdJacobiPrecond;

     44: static PetscErrorCode dvd_improvex_precond_d(dvdDashboard *d)
     45: {
     46:   dvdPCWrapper   *dvdpc = (dvdPCWrapper*)d->improvex_precond_data;

     48:   PetscFunctionBegin;
     49:   /* Free local data */
     50:   PetscCall(PCDestroy(&dvdpc->pc));
     51:   PetscCall(PetscFree(d->improvex_precond_data));
     52:   PetscFunctionReturn(PETSC_SUCCESS);
     53: }

     55: static PetscErrorCode dvd_static_precond_PC_0(dvdDashboard *d,PetscInt i,Vec x,Vec Px)
     56: {
     57:   dvdPCWrapper   *dvdpc = (dvdPCWrapper*)d->improvex_precond_data;

     59:   PetscFunctionBegin;
     60:   PetscCall(PCApply(dvdpc->pc,x,Px));
     61:   PetscFunctionReturn(PETSC_SUCCESS);
     62: }

     64: /*
     65:   Create a trivial preconditioner
     66: */
     67: static PetscErrorCode dvd_precond_none(dvdDashboard *d,PetscInt i,Vec x,Vec Px)
     68: {
     69:   PetscFunctionBegin;
     70:   PetscCall(VecCopy(x,Px));
     71:   PetscFunctionReturn(PETSC_SUCCESS);
     72: }

     74: /*
     75:   Create a static preconditioner from a PC
     76: */
     77: PetscErrorCode dvd_static_precond_PC(dvdDashboard *d,dvdBlackboard *b,PC pc)
     78: {
     79:   dvdPCWrapper   *dvdpc;
     80:   Mat            P;
     81:   PetscBool      t0,t1,t2;

     83:   PetscFunctionBegin;
     84:   /* Setup the step */
     85:   if (b->state >= DVD_STATE_CONF) {
     86:     /* If the preconditioner is valid */
     87:     if (pc) {
     88:       PetscCall(PetscNew(&dvdpc));
     89:       dvdpc->pc = pc;
     90:       PetscCall(PetscObjectReference((PetscObject)pc));
     91:       d->improvex_precond_data = dvdpc;
     92:       d->improvex_precond = dvd_static_precond_PC_0;

     94:       /* PC saves the matrix associated with the linear system, and it has to
     95:          be initialize to a valid matrix */
     96:       PetscCall(PCGetOperatorsSet(pc,NULL,&t0));
     97:       PetscCall(PetscObjectTypeCompare((PetscObject)pc,PCNONE,&t1));
     98:       PetscCall(PetscObjectTypeCompare((PetscObject)pc,PCSHELL,&t2));
     99:       if (t0 && !t1) {
    100:         PetscCall(PCGetOperators(pc,NULL,&P));
    101:         PetscCall(PetscObjectReference((PetscObject)P));
    102:         PetscCall(PCSetOperators(pc,P,P));
    103:         PetscCall(PCSetReusePreconditioner(pc,PETSC_TRUE));
    104:         PetscCall(MatDestroy(&P));
    105:       } else if (t2) {
    106:         PetscCall(PCSetOperators(pc,d->A,d->A));
    107:         PetscCall(PCSetReusePreconditioner(pc,PETSC_TRUE));
    108:       } else {
    109:         d->improvex_precond = dvd_precond_none;
    110:       }

    112:       PetscCall(EPSDavidsonFLAdd(&d->destroyList,dvd_improvex_precond_d));

    114:     /* Else, use no preconditioner */
    115:     } else d->improvex_precond = dvd_precond_none;
    116:   }
    117:   PetscFunctionReturn(PETSC_SUCCESS);
    118: }

    120: static PetscErrorCode dvd_harm_d(dvdDashboard *d)
    121: {
    122:   PetscFunctionBegin;
    123:   /* Free local data */
    124:   PetscCall(PetscFree(d->calcpairs_W_data));
    125:   PetscFunctionReturn(PETSC_SUCCESS);
    126: }

    128: static PetscErrorCode dvd_harm_transf(dvdHarmonic *dvdh,PetscScalar t)
    129: {
    130:   PetscFunctionBegin;
    131:   switch (dvdh->mode) {
    132:   case DVD_HARM_RR:    /* harmonic RR */
    133:     dvdh->Wa = 1.0; dvdh->Wb = t;   dvdh->Pa = 0.0; dvdh->Pb = -1.0;
    134:     break;
    135:   case DVD_HARM_RRR:   /* relative harmonic RR */
    136:     dvdh->Wa = 1.0; dvdh->Wb = t;   dvdh->Pa = 1.0; dvdh->Pb = 0.0;
    137:     break;
    138:   case DVD_HARM_REIGS: /* rightmost eigenvalues */
    139:     dvdh->Wa = 1.0; dvdh->Wb = t;   dvdh->Pa = 1.0; dvdh->Pb = -PetscConj(t);
    140:     break;
    141:   case DVD_HARM_LEIGS: /* largest eigenvalues */
    142:     dvdh->Wa = 0.0; dvdh->Wb = 1.0; dvdh->Pa = 1.0; dvdh->Pb = 0.0;
    143:     break;
    144:   case DVD_HARM_NONE:
    145:   default:
    146:     SETERRQ(PETSC_COMM_SELF,PETSC_ERR_SUP,"Harmonic type not supported");
    147:   }

    149:   /* Check the transformation does not change the sign of the imaginary part */
    150: #if !defined(PETSC_USE_COMPLEX)
    151:   if (dvdh->Pb*dvdh->Wa - dvdh->Wb*dvdh->Pa < 0.0) {
    152:     dvdh->Pa *= -1.0;
    153:     dvdh->Pb *= -1.0;
    154:   }
    155: #endif
    156:   PetscFunctionReturn(PETSC_SUCCESS);
    157: }

    159: static PetscErrorCode dvd_harm_updateW(dvdDashboard *d)
    160: {
    161:   dvdHarmonic    *data = (dvdHarmonic*)d->calcpairs_W_data;
    162:   PetscInt       l,k;
    163:   BV             BX = d->BX?d->BX:d->eps->V;

    165:   PetscFunctionBegin;
    166:   /* Update the target if it is necessary */
    167:   if (!data->withTarget) PetscCall(dvd_harm_transf(data,d->eigr[0]));

    169:   /* W(i) <- Wa*AV(i) - Wb*BV(i) */
    170:   PetscCall(BVGetActiveColumns(d->eps->V,&l,&k));
    171:   PetscAssert(k==l+d->V_new_s,PETSC_COMM_SELF,PETSC_ERR_PLIB,"Consistency broken");
    172:   PetscCall(BVSetActiveColumns(d->W,l+d->V_new_s,l+d->V_new_e));
    173:   PetscCall(BVSetActiveColumns(d->AX,l+d->V_new_s,l+d->V_new_e));
    174:   PetscCall(BVSetActiveColumns(BX,l+d->V_new_s,l+d->V_new_e));
    175:   PetscCall(BVCopy(d->AX,d->W));
    176:   PetscCall(BVScale(d->W,data->Wa));
    177:   PetscCall(BVMult(d->W,-data->Wb,1.0,BX,NULL));
    178:   PetscCall(BVSetActiveColumns(d->W,l,k));
    179:   PetscCall(BVSetActiveColumns(d->AX,l,k));
    180:   PetscCall(BVSetActiveColumns(BX,l,k));
    181:   PetscFunctionReturn(PETSC_SUCCESS);
    182: }

    184: static PetscErrorCode dvd_harm_proj(dvdDashboard *d)
    185: {
    186:   dvdHarmonic    *data = (dvdHarmonic*)d->calcpairs_W_data;
    187:   PetscInt       i,j,l0,l,k,ld;
    188:   PetscScalar    h,g,*H,*G;

    190:   PetscFunctionBegin;
    191:   PetscCall(BVGetActiveColumns(d->eps->V,&l0,&k));
    192:   l = l0 + d->V_new_s;
    193:   k = l0 + d->V_new_e;
    194:   PetscCall(MatGetSize(d->H,&ld,NULL));
    195:   PetscCall(MatDenseGetArray(d->H,&H));
    196:   PetscCall(MatDenseGetArray(d->G,&G));
    197:   /* [H G] <- [Pa*H - Pb*G, Wa*H - Wb*G] */
    198:   /* Right part */
    199:   for (i=l;i<k;i++) {
    200:     for (j=l0;j<k;j++) {
    201:       h = H[ld*i+j];
    202:       g = G[ld*i+j];
    203:       H[ld*i+j] = data->Pa*h - data->Pb*g;
    204:       G[ld*i+j] = data->Wa*h - data->Wb*g;
    205:     }
    206:   }
    207:   /* Left part */
    208:   for (i=l0;i<l;i++) {
    209:     for (j=l;j<k;j++) {
    210:       h = H[ld*i+j];
    211:       g = G[ld*i+j];
    212:       H[ld*i+j] = data->Pa*h - data->Pb*g;
    213:       G[ld*i+j] = data->Wa*h - data->Wb*g;
    214:     }
    215:   }
    216:   PetscCall(MatDenseRestoreArray(d->H,&H));
    217:   PetscCall(MatDenseRestoreArray(d->G,&G));
    218:   PetscFunctionReturn(PETSC_SUCCESS);
    219: }

    221: PetscErrorCode dvd_harm_updateproj(dvdDashboard *d)
    222: {
    223:   dvdHarmonic    *data = (dvdHarmonic*)d->calcpairs_W_data;
    224:   PetscInt       i,j,l,k,ld;
    225:   PetscScalar    h,g,*H,*G;

    227:   PetscFunctionBegin;
    228:   PetscCall(BVGetActiveColumns(d->eps->V,&l,&k));
    229:   k = l + d->V_tra_s;
    230:   PetscCall(MatGetSize(d->H,&ld,NULL));
    231:   PetscCall(MatDenseGetArray(d->H,&H));
    232:   PetscCall(MatDenseGetArray(d->G,&G));
    233:   /* [H G] <- [Pa*H - Pb*G, Wa*H - Wb*G] */
    234:   /* Right part */
    235:   for (i=l;i<k;i++) {
    236:     for (j=0;j<l;j++) {
    237:       h = H[ld*i+j];
    238:       g = G[ld*i+j];
    239:       H[ld*i+j] = data->Pa*h - data->Pb*g;
    240:       G[ld*i+j] = data->Wa*h - data->Wb*g;
    241:     }
    242:   }
    243:   /* Lower triangular part */
    244:   for (i=0;i<l;i++) {
    245:     for (j=l;j<k;j++) {
    246:       h = H[ld*i+j];
    247:       g = G[ld*i+j];
    248:       H[ld*i+j] = data->Pa*h - data->Pb*g;
    249:       G[ld*i+j] = data->Wa*h - data->Wb*g;
    250:     }
    251:   }
    252:   PetscCall(MatDenseRestoreArray(d->H,&H));
    253:   PetscCall(MatDenseRestoreArray(d->G,&G));
    254:   PetscFunctionReturn(PETSC_SUCCESS);
    255: }

    257: static PetscErrorCode dvd_harm_backtrans(dvdHarmonic *data,PetscScalar *ar,PetscScalar *ai)
    258: {
    259:   PetscScalar xr;
    260: #if !defined(PETSC_USE_COMPLEX)
    261:   PetscScalar xi, k;
    262: #endif

    264:   PetscFunctionBegin;
    265:   xr = *ar;
    266: #if !defined(PETSC_USE_COMPLEX)
    267:   xi = *ai;
    268:   if (PetscUnlikely(xi != 0.0)) {
    269:     k = (data->Pa - data->Wa*xr)*(data->Pa - data->Wa*xr) + data->Wa*data->Wa*xi*xi;
    270:     *ar = (data->Pb*data->Pa - (data->Pb*data->Wa + data->Wb*data->Pa)*xr + data->Wb*data->Wa*(xr*xr + xi*xi))/k;
    271:     *ai = (data->Pb*data->Wa - data->Wb*data->Pa)*xi/k;
    272:   } else
    273: #endif
    274:     *ar = (data->Pb - data->Wb*xr) / (data->Pa - data->Wa*xr);
    275:   PetscFunctionReturn(PETSC_SUCCESS);
    276: }

    278: static PetscErrorCode dvd_harm_eig_backtrans(dvdDashboard *d,PetscScalar ar,PetscScalar ai,PetscScalar *br,PetscScalar *bi)
    279: {
    280:   dvdHarmonic    *data = (dvdHarmonic*)d->calcpairs_W_data;

    282:   PetscFunctionBegin;
    283:   PetscCall(dvd_harm_backtrans(data,&ar,&ai));
    284:   *br = ar;
    285:   *bi = ai;
    286:   PetscFunctionReturn(PETSC_SUCCESS);
    287: }

    289: static PetscErrorCode dvd_harm_eigs_trans(dvdDashboard *d)
    290: {
    291:   dvdHarmonic    *data = (dvdHarmonic*)d->calcpairs_W_data;
    292:   PetscInt       i,l,k;

    294:   PetscFunctionBegin;
    295:   PetscCall(BVGetActiveColumns(d->eps->V,&l,&k));
    296:   for (i=0;i<k-l;i++) PetscCall(dvd_harm_backtrans(data,&d->eigr[i],&d->eigi[i]));
    297:   PetscFunctionReturn(PETSC_SUCCESS);
    298: }

    300: PetscErrorCode dvd_harm_conf(dvdDashboard *d,dvdBlackboard *b,HarmType_t mode,PetscBool fixedTarget,PetscScalar t)
    301: {
    302:   dvdHarmonic    *dvdh;

    304:   PetscFunctionBegin;
    305:   /* Set the problem to GNHEP:
    306:      d->G maybe is upper triangular due to biorthogonality of V and W */
    307:   d->sEP = d->sA = d->sB = 0;

    309:   /* Setup the step */
    310:   if (b->state >= DVD_STATE_CONF) {
    311:     PetscCall(PetscNew(&dvdh));
    312:     dvdh->withTarget = fixedTarget;
    313:     dvdh->mode = mode;
    314:     if (fixedTarget) PetscCall(dvd_harm_transf(dvdh, t));
    315:     d->calcpairs_W_data = dvdh;
    316:     d->calcpairs_W = dvd_harm_updateW;
    317:     d->calcpairs_proj_trans = dvd_harm_proj;
    318:     d->calcpairs_eigs_trans = dvd_harm_eigs_trans;
    319:     d->calcpairs_eig_backtrans = dvd_harm_eig_backtrans;

    321:     PetscCall(EPSDavidsonFLAdd(&d->destroyList,dvd_harm_d));
    322:   }
    323:   PetscFunctionReturn(PETSC_SUCCESS);
    324: }