diff-grok 1.2.0 → 1.3.1

package/src/solver-tools/cvode/common.ts

@@ -1,549 +0,0 @@
-/**
- * TypeScript port of SUNDIALS CVODE v7.5.0 (https://github.com/LLNL/sundials)
- *
- * Copyright (c) 2025, Lawrence Livermore National Security, University of
- *   Maryland Baltimore County, and the SUNDIALS contributors.
- * Copyright (c) 2013-2025, Lawrence Livermore National Security and
- *   Southern Methodist University.
- * Copyright (c) 2002-2013, Lawrence Livermore National Security.
- * Copyright (c) 2026 Datagrok.
- *
- * Licensed under the BSD-3-Clause License. See THIRD_PARTY_LICENSES
- * for the full license text and provenance chain of the original code.
- */
-
-// CVODE TypeScript port - Foundation types, constants, and data structures
-// Ported from SUNDIALS CVODE v7.5.0 (cvode_impl.h, cvode_ls_impl.h)
-// All arrays are 0-based.
-
-// ============================================================================
-// Constants from cvode_impl.h
-// ============================================================================
-
-// --- Method order limits ---
-export const ADAMS_Q_MAX = 12;
-export const BDF_Q_MAX = 5;
-export const Q_MAX = 12;
-export const L_MAX = 13; // Q_MAX + 1
-export const NUM_TESTS = 5;
-
-// --- Linear multistep method types ---
-export const CV_ADAMS = 1;
-export const CV_BDF = 2;
-
-// --- Task types ---
-export const CV_NORMAL = 1; // integrate to tout, interpolate
-export const CV_ONE_STEP = 2; // take one internal step
-
-// --- Return values (success) ---
-export const CV_SUCCESS = 0;
-export const CV_TSTOP_RETURN = 1;
-export const CV_ROOT_RETURN = 2;
-
-// --- Return values (failure) ---
-export const CV_TOO_MUCH_WORK = -1;
-export const CV_TOO_MUCH_ACC = -2;
-export const CV_ERR_FAILURE = -3;
-export const CV_CONV_FAILURE = -4;
-export const CV_RHSFUNC_FAIL = -8;
-export const CV_FIRST_RHSFUNC_ERR = -9;
-export const CV_RTFUNC_FAIL = -12;
-export const CV_TOO_CLOSE = -27;
-
-// --- Default values ---
-export const HMIN_DEFAULT = 0.0;
-export const HMAX_INV_DEFAULT = 0.0;
-export const MXHNIL_DEFAULT = 10;
-export const MXSTEP_DEFAULT = 500;
-export const MSBP_DEFAULT = 20;
-export const DGMAX_LSETUP_DEFAULT = 0.3;
-
-// --- Eta (step size ratio) defaults ---
-export const ETA_MIN_FX_DEFAULT = 0.0;
-export const ETA_MAX_FX_DEFAULT = 1.5;
-export const ETA_MAX_FS_DEFAULT = 10000.0;
-export const ETA_MAX_ES_DEFAULT = 10.0;
-export const ETA_MAX_GS_DEFAULT = 10.0;
-export const ETA_MIN_DEFAULT = 0.1;
-export const ETA_MAX_EF_DEFAULT = 0.2;
-export const ETA_MIN_EF_DEFAULT = 0.1;
-export const ETA_CF_DEFAULT = 0.25;
-export const SMALL_NST_DEFAULT = 10;
-export const SMALL_NEF_DEFAULT = 2;
-export const ONEPSM = 1.000001;
-
-// --- Step size selection bias factors ---
-export const ADDON = 0.000001;
-export const BIAS1 = 6.0;
-export const BIAS2 = 6.0;
-export const BIAS3 = 10.0;
-export const LONG_WAIT = 10;
-
-// --- Failure limits ---
-export const MXNCF = 10; // max convergence failures per step
-export const MXNEF = 7; // max error test failures per step
-export const MXNEF1 = 3; // max error test failures on first step
-
-// --- Internal action flags ---
-export const DO_ERROR_TEST = 2;
-export const PREDICT_AGAIN = 3;
-export const TRY_AGAIN = 5;
-export const FIRST_CALL = 6;
-export const PREV_CONV_FAIL = 7;
-export const PREV_ERR_FAIL = 9;
-export const RHSFUNC_RECVR = 10;
-
-// --- Tolerance types ---
-export const CV_NN = 0; // no tolerances set
-export const CV_SS = 1; // scalar-scalar
-export const CV_SV = 2; // scalar-vector
-
-// --- Nonlinear solver failure types ---
-export const CV_NO_FAILURES = 0;
-export const CV_FAIL_BAD_J = 1;
-export const CV_FAIL_OTHER = 2;
-
-// --- Initial step size estimation ---
-export const FUZZ_FACTOR = 100.0;
-export const HLB_FACTOR = 100.0;
-export const HUB_FACTOR = 0.1;
-export const H_BIAS = 0.5;
-export const MAX_ITERS = 4;
-export const CORTES = 0.1;
-export const TINY = 1.0e-10;
-
-// --- Nonlinear solver constants ---
-export const NLS_MAXCOR = 3; // max corrector iterations
-export const CRDOWN = 0.3; // convergence rate damping
-export const RDIV = 2.0; // divergence threshold
-
-// --- SUNNonlinearSolver return codes (simplified) ---
-export const SUN_NLS_CONTINUE = 901;
-export const SUN_NLS_CONV_RECVR = 902;
-
-// --- Additional failure codes ---
-export const CV_LSETUP_FAIL = -13;
-export const CV_LSOLVE_FAIL = -14;
-export const CV_UNREC_RHSFUNC_ERR = -10;
-export const CV_REPTD_RHSFUNC_ERR = -11;
-export const CV_LINIT_FAIL = -31;
-export const CV_NLS_INIT_FAIL = -32;
-export const CV_NLS_FAIL = -33;
-
-// --- Machine epsilon ---
-export const UROUND = 2.2204460492503131e-16;
-
-// --- Rootfinding constants ---
-export const RTFOUND = 1;
-export const CLOSERT = 3;
-
-// --- Linear solver constants (from cvode_ls_impl.h) ---
-export const CVLS_MSBJ = 51; // max steps between Jacobian evals
-export const CVLS_DGMAX = 0.2; // gamma change threshold for Jacobian redo
-
-// ============================================================================
-// Function types
-// ============================================================================
-
-/** RHS function: y' = f(t, y). Returns 0 on success, non-zero on failure. */
-export type CvodeRhsFn = (t: number, y: Float64Array, ydot: Float64Array, userData: any) => number;
-
-/** Jacobian function: J = df/dy. Returns 0 on success, non-zero on failure. */
-export type CvodeJacFn = (t: number, y: Float64Array, fy: Float64Array, J: Float64Array[], userData: any) => number;
-
-/** Root function: g(t, y). Returns 0 on success, non-zero on failure. */
-export type CvodeRootFn = (t: number, y: Float64Array, gout: Float64Array, userData: any) => number;
-
-// ============================================================================
-// CvLsMem - Linear solver memory (maps CVLsMemRec from cvode_ls_impl.h)
-// ============================================================================
-
-export class CvLsMem {
-  /** N x N Jacobian matrix (row-major) */
-  A: Float64Array[] = [];
-  /** LU pivot indices */
-  pivots: Int32Array = new Int32Array(0);
-  /** Saved copy of Jacobian */
-  savedJ: Float64Array[] = [];
-  /** User-supplied Jacobian function */
-  jacFn: CvodeJacFn | null = null;
-  /** Use difference-quotient Jacobian by default */
-  jacDQ: boolean = true;
-  /** Number of Jacobian evaluations */
-  nje: number = 0;
-  /** Number of f evaluations for DQ Jacobian */
-  nfeDQ: number = 0;
-  /** nst at last Jacobian evaluation */
-  nstlj: number = 0;
-  /** t at last Jacobian evaluation */
-  tnlj: number = 0;
-  /** Max steps between Jacobian evaluations (CVLS_MSBJ) */
-  msbj: number = CVLS_MSBJ;
-  /** Gamma change threshold (CVLS_DGMAX) */
-  dgmax_jbad: number = CVLS_DGMAX;
-  /** Is Jacobian stale? */
-  jbad: boolean = true;
-}
-
-// ============================================================================
-// CvodeMem - Main solver state (maps CVodeMemRec from cvode_impl.h)
-// ============================================================================
-
-export class CvodeMem {
-  // --- Problem specification ---
-  /** RHS function: y' = f(t, y) */
-  cv_f: CvodeRhsFn | null = null;
-  /** User data passed to f, jac, root functions */
-  cv_user_data: any = null;
-  /** Linear multistep method: CV_ADAMS or CV_BDF */
-  cv_lmm: number = 0;
-  /** Tolerance type: CV_NN, CV_SS, or CV_SV */
-  cv_itol: number = CV_NN;
-
-  // --- Tolerances ---
-  /** Relative tolerance */
-  cv_reltol: number = 0;
-  /** Scalar absolute tolerance */
-  cv_Sabstol: number = 0;
-  /** Vector absolute tolerance */
-  cv_Vabstol: Float64Array = new Float64Array(0);
-  /** Flag: is min(atol) == 0? */
-  cv_atolmin0: boolean = false;
-
-  // --- Nordsieck history array ---
-  /** Nordsieck array: cv_zn[j][i], j=0..q, i=0..N-1 */
-  cv_zn: Float64Array[] = [];
-
-  // --- Work vectors ---
-  /** Error weight vector */
-  cv_ewt: Float64Array = new Float64Array(0);
-  /** Solution vector (scratch for user output) */
-  cv_y: Float64Array = new Float64Array(0);
-  /** Accumulated correction */
-  cv_acor: Float64Array = new Float64Array(0);
-  /** Temporary vector */
-  cv_tempv: Float64Array = new Float64Array(0);
-  /** Temporary for f evaluations */
-  cv_ftemp: Float64Array = new Float64Array(0);
-  /** Temporary vector 1 */
-  cv_vtemp1: Float64Array = new Float64Array(0);
-  /** Temporary vector 2 */
-  cv_vtemp2: Float64Array = new Float64Array(0);
-  /** Temporary vector 3 */
-  cv_vtemp3: Float64Array = new Float64Array(0);
-
-  // --- Tstop ---
-  /** Is tstop set? */
-  cv_tstopset: boolean = false;
-  /** Interpolate at tstop? */
-  cv_tstopinterp: boolean = false;
-  /** Stop time */
-  cv_tstop: number = 0;
-
-  // --- Step data ---
-  /** Current method order */
-  cv_q: number = 0;
-  /** Order for next step */
-  cv_qprime: number = 0;
-  /** Next order to be used (during step) */
-  cv_next_q: number = 0;
-  /** Steps remaining before order change allowed */
-  cv_qwait: number = 0;
-  /** L = q + 1 */
-  cv_L: number = 0;
-  /** Initial step size (user-supplied) */
-  cv_hin: number = 0;
-  /** Current step size */
-  cv_h: number = 0;
-  /** Step size for next step */
-  cv_hprime: number = 0;
-  /** Next h (during step) */
-  cv_next_h: number = 0;
-  /** Step size ratio: hprime / h */
-  cv_eta: number = 0;
-  /** Step size at last Nordsieck rescale */
-  cv_hscale: number = 0;
-  /** Current internal time */
-  cv_tn: number = 0;
-  /** Last return time */
-  cv_tretlast: number = 0;
-  /** Step size history: tau[i], i=0..L_MAX */
-  cv_tau: Float64Array = new Float64Array(L_MAX + 1);
-  /** Error test quantities: tq[i], i=0..NUM_TESTS */
-  cv_tq: Float64Array = new Float64Array(NUM_TESTS + 1);
-  /** Polynomial coefficients: l[i], i=0..L_MAX-1 */
-  cv_l: Float64Array = new Float64Array(L_MAX);
-  /** 1 / l[1] */
-  cv_rl1: number = 0;
-  /** gamma = h * rl1 */
-  cv_gamma: number = 0;
-  /** gamma at last setup */
-  cv_gammap: number = 0;
-  /** gamma / gammap */
-  cv_gamrat: number = 0;
-  /** NLS convergence rate estimate */
-  cv_crate: number = 0;
-  /** Previous del value (NLS) */
-  cv_delp: number = 0;
-  /** WRMS norm of accumulated correction */
-  cv_acnrm: number = 0;
-  /** Current acnrm (during step) */
-  cv_acnrmcur: boolean = false;
-  /** NLS convergence coefficient */
-  cv_nlscoef: number = 0;
-
-  // --- Limits ---
-  /** Max method order */
-  cv_qmax: number = 0;
-  /** Max internal steps per call */
-  cv_mxstep: number = MXSTEP_DEFAULT;
-  /** Max t+h==t warnings */
-  cv_mxhnil: number = MXHNIL_DEFAULT;
-  /** Max error test failures per step */
-  cv_maxnef: number = MXNEF;
-  /** Max convergence failures per step */
-  cv_maxncf: number = MXNCF;
-  /** Min step size */
-  cv_hmin: number = HMIN_DEFAULT;
-  /** 1/hmax (inverse of max step size) */
-  cv_hmax_inv: number = HMAX_INV_DEFAULT;
-  /** Max eta for step size increase */
-  cv_etamax: number = 0;
-  /** Min fixed eta threshold */
-  cv_eta_min_fx: number = ETA_MIN_FX_DEFAULT;
-  /** Max fixed eta threshold */
-  cv_eta_max_fx: number = ETA_MAX_FX_DEFAULT;
-  /** Max eta on first step */
-  cv_eta_max_fs: number = ETA_MAX_FS_DEFAULT;
-  /** Max eta on early steps */
-  cv_eta_max_es: number = ETA_MAX_ES_DEFAULT;
-  /** Max eta on general steps */
-  cv_eta_max_gs: number = ETA_MAX_GS_DEFAULT;
-  /** Min eta */
-  cv_eta_min: number = ETA_MIN_DEFAULT;
-  /** Min eta on error failure */
-  cv_eta_min_ef: number = ETA_MIN_EF_DEFAULT;
-  /** Max eta on error failure */
-  cv_eta_max_ef: number = ETA_MAX_EF_DEFAULT;
-  /** Eta on convergence failure */
-  cv_eta_cf: number = ETA_CF_DEFAULT;
-  /** Small step count threshold */
-  cv_small_nst: number = SMALL_NST_DEFAULT;
-  /** Small error failure threshold */
-  cv_small_nef: number = SMALL_NEF_DEFAULT;
-
-  // --- Counters ---
-  /** Total internal steps taken */
-  cv_nst: number = 0;
-  /** Total RHS evaluations */
-  cv_nfe: number = 0;
-  /** Convergence failures */
-  cv_ncfn: number = 0;
-  /** Nonlinear iterations */
-  cv_nni: number = 0;
-  /** Nonlinear iteration failures */
-  cv_nnf: number = 0;
-  /** Error test failures */
-  cv_netf: number = 0;
-  /** Linear solver setups */
-  cv_nsetups: number = 0;
-  /** t+h==t warnings */
-  cv_nhnil: number = 0;
-
-  // --- Step size ratios for order selection ---
-  /** Eta for order q-1 */
-  cv_etaqm1: number = 0;
-  /** Eta for order q */
-  cv_etaq: number = 0;
-  /** Eta for order q+1 */
-  cv_etaqp1: number = 0;
-
-  // --- Linear solver interface ---
-  /** Linear solver init function */
-  cv_linit: ((mem: CvodeMem) => number) | null = null;
-  /** Linear solver setup function */
-  cv_lsetup: ((mem: CvodeMem, convfail: number, ypred: Float64Array,
-               fpred: Float64Array, jcurPtr: { value: boolean },
-               tmp1: Float64Array, tmp2: Float64Array,
-               tmp3: Float64Array) => number) | null = null;
-  /** Linear solver solve function */
-  cv_lsolve: ((mem: CvodeMem, b: Float64Array, weight: Float64Array,
-               ycur: Float64Array, fcur: Float64Array) => number) | null = null;
-  /** Linear solver free function */
-  cv_lfree: ((mem: CvodeMem) => void) | null = null;
-  /** Linear solver memory */
-  cv_lmem: CvLsMem | null = null;
-  /** Max steps between Jacobian setups */
-  cv_msbp: number = MSBP_DEFAULT;
-  /** Gamma change threshold for Jacobian redo */
-  cv_dgmax_lsetup: number = DGMAX_LSETUP_DEFAULT;
-
-  // --- Saved values ---
-  /** Order used on last successful step */
-  cv_qu: number = 0;
-  /** nst at last Jacobian setup */
-  cv_nstlp: number = 0;
-  /** Initial step size actually used */
-  cv_h0u: number = 0;
-  /** Step size used on last successful step */
-  cv_hu: number = 0;
-  /** Saved tq[5] for order selection */
-  cv_saved_tq5: number = 0;
-  /** Is Jacobian current? */
-  cv_jcur: boolean = false;
-  /** Tolerance scale factor */
-  cv_tolsf: number = 0;
-  /** Max order allocated in Nordsieck array */
-  cv_qmax_alloc: number = 0;
-  /** Index of acor in zn array */
-  cv_indx_acor: number = 0;
-
-  // --- Initialization flags ---
-  /** Has CvodeMem been allocated/initialized? */
-  cv_MallocDone: boolean = false;
-  /** Has vector abstol been allocated? */
-  cv_VabstolMallocDone: boolean = false;
-
-  // --- BDF stability limit detection ---
-  /** Enable stability limit detection? */
-  cv_sldeton: boolean = false;
-  /** Stability data: ssdat[6][4] (6 rows, 4 cols) */
-  cv_ssdat: number[][] = [];
-  /** Steps since stability check */
-  cv_nscon: number = 0;
-  /** Order flag for stability */
-  cv_nor: number = 0;
-
-  // --- Rootfinding ---
-  /** Root function */
-  cv_gfun: CvodeRootFn | null = null;
-  /** Number of root functions */
-  cv_nrtfn: number = 0;
-  /** Root direction info (which roots were found) */
-  cv_iroots: Int32Array = new Int32Array(0);
-  /** Root direction constraints */
-  cv_rootdir: Int32Array = new Int32Array(0);
-  /** t at low end of bracket */
-  cv_tlo: number = 0;
-  /** t at high end of bracket */
-  cv_thi: number = 0;
-  /** t at root */
-  cv_trout: number = 0;
-  /** g values at low end */
-  cv_glo: Float64Array = new Float64Array(0);
-  /** g values at high end */
-  cv_ghi: Float64Array = new Float64Array(0);
-  /** g values at root */
-  cv_grout: Float64Array = new Float64Array(0);
-  /** Output time saved for root check */
-  cv_toutc: number = 0;
-  /** Root time tolerance */
-  cv_ttol: number = 0;
-  /** Task flag for root check */
-  cv_taskc: number = 0;
-  /** Root found on previous step? */
-  cv_irfnd: number = 0;
-  /** Number of g evaluations */
-  cv_nge: number = 0;
-  /** Active root functions flags */
-  cv_gactive: Uint8Array = new Uint8Array(0);
-  /** Max steps with g inactive before declaring permanently inactive */
-  cv_mxgnull: number = 1;
-
-  // --- NLS ---
-  /** Convergence failure type (CV_NO_FAILURES, CV_FAIL_BAD_J, CV_FAIL_OTHER) */
-  convfail: number = CV_NO_FAILURES;
-
-  // --- Error ---
-  /** Error message string */
-  cv_error: string = '';
-
-  // --- Problem size ---
-  /** Number of equations */
-  cv_N: number = 0;
-
-  // --- Resize flag ---
-  /** First step after problem resize */
-  first_step_after_resize: boolean = false;
-}
-
-// ============================================================================
-// Utility functions
-// ============================================================================
-
-/**
- * Weighted root-mean-square norm.
- * Returns sqrt(sum((v[i]*w[i])^2) / n) for i = 0..n-1.
- */
-export function wrmsNorm(n: number, v: Float64Array, w: Float64Array): number {
-  let sum = 0.0;
-  for (let i = 0; i < n; i++) {
-    const vw = v[i] * w[i];
-    sum += vw * vw;
-  }
-  return Math.sqrt(sum / n);
-}
-
-/**
- * Linear combination of two vectors: z[i] = a*x[i] + b*y[i] for i = 0..n-1.
- */
-export function vLinearSum(a: number, x: Float64Array, b: number, y: Float64Array,
-  z: Float64Array, n: number): void {
-  for (let i = 0; i < n; i++)
-    z[i] = a * x[i] + b * y[i];
-}
-
-/**
- * Scale a vector: z[i] = c * x[i] for i = 0..n-1.
- */
-export function vScale(c: number, x: Float64Array, z: Float64Array, n: number): void {
-  for (let i = 0; i < n; i++)
-    z[i] = c * x[i];
-}
-
-/**
- * Set all elements of a vector to a constant: z[i] = c for i = 0..n-1.
- */
-export function vConst(c: number, z: Float64Array, n: number): void {
-  z.fill(c, 0, n);
-}
-
-/**
- * Dense output interpolation from the Nordsieck history array.
- *
- * Computes the k-th derivative of the interpolating polynomial at time t:
- *   dky = sum_{j=k}^{q} c(j,k) * s^(j-k) * h^(-k) * zn[j]
- * where s = (t - tn) / h, c(j,k) = j*(j-1)*...*(j-k+1).
- *
- * @returns 0 on success, -1 on invalid input.
- */
-export function cvodeGetDky(
-  mem: CvodeMem, t: number, k: number, dky: Float64Array,
-): number {
-  if (k < 0 || k > mem.cv_q) return -1;
-
-  const N = mem.cv_N;
-  const tfuzz = FUZZ_FACTOR * UROUND *
-    (Math.abs(mem.cv_tn) + Math.abs(mem.cv_hu));
-  const tp = mem.cv_tn - mem.cv_hu - Math.abs(tfuzz);
-  const tn1 = mem.cv_tn + Math.abs(tfuzz);
-  if ((t - tp) * (t - tn1) > 0) return -1;
-
-  const s = (t - mem.cv_tn) / mem.cv_h;
-
-  dky.fill(0.0, 0, N);
-  for (let j = mem.cv_q; j >= k; j--) {
-    let c = 1.0;
-    for (let i = j; i >= j - k + 1; i--) c *= i;
-    for (let i = 0; i < j - k; i++) c *= s;
-    const znj = mem.cv_zn[j];
-    for (let i = 0; i < N; i++) dky[i] += c * znj[i];
-  }
-
-  if (k > 0) {
-    const r = Math.pow(mem.cv_h, -k);
-    for (let i = 0; i < N; i++) dky[i] *= r;
-  }
-
-  return 0;
-}

package/src/solver-tools/cvode/cvode.js.map

@@ -1 +0,0 @@
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