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scirs2_special/
parabolic.rs

1//! Parabolic Cylinder Functions
2//!
3//! This module provides implementations of the Parabolic Cylinder functions,
4//! which are solutions to the differential equation:
5//!
6//! d²y/dx² + (v + 1/2 - x²/4)y = 0
7//!
8//! These functions have applications in quantum mechanics, wave propagation,
9//! and other areas of mathematical physics.
10
11use std::f64::consts::{PI, SQRT_2};
12// use scirs2_core::numeric::Float;
13// use scirs2_core::numeric::Complex64;
14
15use crate::error::{SpecialError, SpecialResult};
16use crate::gamma::{gamma, gammaln};
17
18/// Parabolic cylinder function D_v(x) and its derivative.
19///
20/// The parabolic cylinder function D_v(x) is a solution to the differential equation:
21/// d²y/dx² + (v + 1/2 - x²/4)y = 0
22///
23/// # Arguments
24///
25/// * `v` - Order parameter
26/// * `x` - Real argument
27///
28/// # Returns
29///
30/// * A tuple containing (D_v(x), D_v'(x))
31///
32/// # Examples
33///
34/// ```
35/// use scirs2_special::pbdv;
36///
37/// let (d, dp) = pbdv(1.0, 0.5).unwrap();
38/// println!("D_1(0.5) = {}, D_1'(0.5) = {}", d, dp);
39/// ```
40#[allow(dead_code)]
41pub fn pbdv(v: f64, x: f64) -> SpecialResult<(f64, f64)> {
42    if v.is_nan() || x.is_nan() {
43        return Err(SpecialError::DomainError("NaN input to pbdv".to_string()));
44    }
45
46    // Special cases for v = 0, ±1, ±2
47    if v == 0.0 {
48        return pbdv_0(x);
49    } else if v == 1.0 {
50        return pbdv_1(x);
51    } else if v == 2.0 {
52        return pbdv_2(x);
53    } else if v == -1.0 {
54        return pbdv_m1(x);
55    } else if v == -2.0 {
56        return pbdv_m2(x);
57    }
58
59    // General case
60    if v.floor() == v && (-20.0..=20.0).contains(&v) {
61        // Integer case - use recurrence relations
62        pbdv_integer(v as i32, x)
63    } else {
64        // General case - use series expansion
65        pbdv_general(v, x)
66    }
67}
68
69/// Implementation of D_0(x) for v = 0
70#[allow(dead_code)]
71fn pbdv_0(x: f64) -> SpecialResult<(f64, f64)> {
72    // D_0(x) = e^(-x²/4)
73    let x2 = x * x;
74    let d = (-x2 / 4.0).exp();
75    // D_0'(x) = -x/2 * e^(-x²/4)
76    let dp = -x / 2.0 * d;
77
78    Ok((d, dp))
79}
80
81/// Implementation of D_1(x) for v = 1
82#[allow(dead_code)]
83fn pbdv_1(x: f64) -> SpecialResult<(f64, f64)> {
84    // D_1(x) = x * e^(-x²/4)
85    let x2 = x * x;
86    let exp_term = (-x2 / 4.0).exp();
87    let d = x * exp_term;
88    // D_1'(x) = (1 - x²/2) * e^(-x²/4)
89    let dp = (1.0 - x2 / 2.0) * exp_term;
90
91    Ok((d, dp))
92}
93
94/// Implementation of D_2(x) for v = 2
95#[allow(dead_code)]
96fn pbdv_2(x: f64) -> SpecialResult<(f64, f64)> {
97    // D_2(x) = (x² - 2) * e^(-x²/4)
98    let x2 = x * x;
99    let exp_term = (-x2 / 4.0).exp();
100    let d = (x2 - 2.0) * exp_term;
101    // D_2'(x) = x * (x² - 4) * e^(-x²/4) / 2
102    let dp = x * (x2 - 4.0) * exp_term / 2.0;
103
104    Ok((d, dp))
105}
106
107/// Implementation of D_{-1}(x) for v = -1
108#[allow(dead_code)]
109fn pbdv_m1(x: f64) -> SpecialResult<(f64, f64)> {
110    // D_{-1}(x) = (√(π/2) * e^(x²/4) * [1 - erf(x/√2)]) - x*e^(-x²/4)/2
111    let x2 = x * x;
112    let sqrt_pi_over_2 = (PI / 2.0).sqrt();
113    let exp_pos = (x2 / 4.0).exp();
114    let exp_neg = (-x2 / 4.0).exp();
115
116    // Error function approximation
117    let erf_val = erf_approx(x / SQRT_2);
118
119    let d = sqrt_pi_over_2 * exp_pos * (1.0 - erf_val) - x * exp_neg / 2.0;
120
121    // Derivative calculation
122    let dp = x * d / 2.0 + exp_neg;
123
124    Ok((d, dp))
125}
126
127/// Implementation of D_{-2}(x) for v = -2
128#[allow(dead_code)]
129fn pbdv_m2(x: f64) -> SpecialResult<(f64, f64)> {
130    // D_{-2}(x) can be calculated using recurrence relations with D_{-1} and D_0
131    let (d_m1, _) = pbdv_m1(x)?;
132    let (d_0, _) = pbdv_0(x)?;
133
134    let d = x * d_m1 - d_0;
135    let dp = d_m1 - x * d / 2.0;
136
137    Ok((d, dp))
138}
139
140/// Implementation of D_v(x) for integer v using recurrence relations
141#[allow(dead_code)]
142fn pbdv_integer(v: i32, x: f64) -> SpecialResult<(f64, f64)> {
143    if v >= 0 {
144        // Forward recurrence for positive v
145        let (d0, d0p) = pbdv_0(x)?;
146        let (d1, d1p) = pbdv_1(x)?;
147
148        let mut d_prev = d0;
149        let mut d = d1;
150        let mut dp_prev = d0p;
151        let mut dp = d1p;
152
153        for k in 1..v {
154            let d_next = x * d - k as f64 * d_prev;
155            let dp_next = x * dp - k as f64 * dp_prev - d;
156
157            d_prev = d;
158            d = d_next;
159            dp_prev = dp;
160            dp = dp_next;
161        }
162
163        Ok((d, dp))
164    } else {
165        // Backward recurrence for negative v
166        let (d0, d0p) = pbdv_0(x)?;
167        let (dm1, dm1p) = pbdv_m1(x)?;
168
169        let mut d_prev = dm1;
170        let mut d = d0;
171        let mut dp_prev = dm1p;
172        let mut dp = d0p;
173
174        for k in 0..(-v - 1) {
175            let d_next = (x * d + d_prev) / (k as f64 + 1.0);
176            let dp_next = (x * dp + dp_prev - d) / (k as f64 + 1.0);
177
178            d_prev = d;
179            d = d_next;
180            dp_prev = dp;
181            dp = dp_next;
182        }
183
184        Ok((d, dp))
185    }
186}
187
188/// General implementation of D_v(x) for any v using series expansions
189#[allow(dead_code)]
190fn pbdv_general(v: f64, x: f64) -> SpecialResult<(f64, f64)> {
191    // For small |x|, use power series
192    if x.abs() < 5.0 {
193        return pbdv_series(v, x);
194    }
195
196    // For large positive x, use asymptotic expansion
197    if x > 0.0 && x.abs() > (2.0 * v.abs()).max(20.0) {
198        return pbdv_asymptotic_pos(v, x);
199    }
200
201    // For large negative x, use relationship with V_v
202    if x < 0.0 && x.abs() > (2.0 * v.abs()).max(20.0) {
203        return pbdv_asymptotic_neg(v, x);
204    }
205
206    // Fallback to numerical integration using the series expansion
207    pbdv_series(v, x)
208}
209
210/// Power series implementation for D_v(x) with enhanced numerical stability
211#[allow(dead_code)]
212fn pbdv_series(v: f64, x: f64) -> SpecialResult<(f64, f64)> {
213    // Special case for x = 0
214    if x == 0.0 {
215        // When x = 0, D_v(0) = 2^(-v/2) * Γ((1+v)/2) / Γ(1)
216        // And D_v'(0) = 0 for v > 0, and infinity for v <= 0
217        let gamma_1_plus_v_half = gamma((1.0 + v) / 2.0);
218        let gamma_1 = 1.0; // gamma(1.0) is always 1.0
219        let d_at_zero = 2_f64.powf(-v / 2.0) * gamma_1_plus_v_half / gamma_1;
220        let dp_at_zero = if v > 0.0 { 0.0 } else { f64::INFINITY };
221        return Ok((d_at_zero, dp_at_zero));
222    }
223
224    // Special case for very large |x|
225    if x.abs() > 100.0 {
226        // For very large |x|, use the asymptotic form instead
227        return if x > 0.0 {
228            pbdv_asymptotic_pos(v, x)
229        } else {
230            pbdv_asymptotic_neg(v, x)
231        };
232    }
233
234    // For normal range of x, use enhanced series method
235    let x2 = x * x;
236
237    // Use log-based computation for the exponential term to avoid underflow
238    let log_exp_term = -x2 / 4.0;
239
240    // Only compute the actual exponent if it won't underflow
241    let exp_term = if log_exp_term < -700.0 {
242        0.0 // Effectively zero due to underflow
243    } else {
244        log_exp_term.exp()
245    };
246
247    // Series for D_v(x)
248    let mut d_sum; // Will be set in the loop
249    let mut dp_sum = 0.0;
250
251    // For numerical stability, keep track of previous sums to detect stagnation
252    let mut prev_d_sum = 0.0;
253    let mut prev_dp_sum = 0.0;
254    let mut stagnation_count = 0;
255
256    // Initial coefficient computation, using log-space for better precision
257    let v_half = v / 2.0;
258    let log_first_term = -v_half * 2.0_f64.ln() + gammaln(1.0 + v_half) - gammaln(1.0);
259    let first_term = log_first_term.exp();
260
261    let mut term = first_term;
262    let mut dp_term = 0.0;
263    d_sum = term;
264
265    // Extended iteration limit for more challenging cases
266    for k in 1..100 {
267        // Different handling for odd and even k
268        if k % 2 == 0 {
269            // Even k - computation in log space to avoid overflow/underflow
270            let k_f64 = k as f64;
271            let log_coef = (k / 2) as f64 * (-(k_f64) / 2.0).ln() - log_factorial(k);
272            let coef = log_coef.exp();
273
274            // For x^k, use log-space if k is large
275            let sign_correction = if x < 0.0 && k % 2 == 1 { -1.0 } else { 1.0 };
276            let log_x_pow_k = k_f64 * x.abs().ln();
277            let x_pow_k = sign_correction * log_x_pow_k.exp();
278
279            // Compute terms with protection against overflow
280            let new_term = coef * x_pow_k;
281
282            // For derivatives, we need x^(k-1)
283            let x_pow_kminus_1 = if k > 0 { x_pow_k / x } else { 1.0 };
284            let new_dp_term = coef * x_pow_kminus_1 * k_f64;
285
286            if new_term.is_finite() {
287                term = new_term;
288                d_sum += term;
289            }
290
291            if new_dp_term.is_finite() {
292                dp_term = new_dp_term;
293                dp_sum += dp_term;
294            }
295        } else {
296            // Odd k - similar approach
297            let k_f64 = k as f64;
298            let log_coef = ((k - 1) / 2) as f64 * (-(k_f64) / 2.0).ln() - log_factorial(k);
299            let coef = log_coef.exp();
300
301            // For x^k
302            let sign_correction = if x < 0.0 && k % 2 == 1 { -1.0 } else { 1.0 };
303            let log_x_pow_k = k_f64 * x.abs().ln();
304            let x_pow_k = sign_correction * log_x_pow_k.exp();
305
306            let new_term = coef * x_pow_k;
307
308            if new_term.is_finite() {
309                term = new_term;
310                d_sum += term;
311
312                // For odd k, the derivative term is calculated differently
313                dp_term = term * k_f64 / x;
314                dp_sum += dp_term;
315            }
316        }
317
318        // Multiple convergence criteria
319
320        // Absolute tolerance
321        let abs_tol = 1e-15;
322
323        // Relative tolerance (protecting against division by zero)
324        let d_rel_tol = 1e-15 * d_sum.abs().max(1e-300);
325        let dp_rel_tol = 1e-15 * dp_sum.abs().max(1e-300);
326
327        // First convergence check: terms becoming small relative to sum
328        if (term.abs() < abs_tol || term.abs() < d_rel_tol)
329            && (dp_term.abs() < abs_tol || dp_term.abs() < dp_rel_tol)
330        {
331            break;
332        }
333
334        // Second check: detect series stagnation
335        if (d_sum - prev_d_sum).abs() < d_rel_tol && (dp_sum - prev_dp_sum).abs() < dp_rel_tol {
336            stagnation_count += 1;
337            if stagnation_count >= 3 {
338                // Series has stopped making meaningful progress
339                break;
340            }
341        } else {
342            stagnation_count = 0;
343        }
344
345        // Safety check for very small terms that won't affect the result
346        if k > 50 && term.abs() < 1e-30 && dp_term.abs() < 1e-30 {
347            break;
348        }
349
350        prev_d_sum = d_sum;
351        prev_dp_sum = dp_sum;
352    }
353
354    // Final calculation with careful handling of potential overflow/underflow
355    let d = d_sum * exp_term;
356
357    // Derivative calculation: D_v'(x) = derivative of series - x/2 * D_v(x)
358    let dp = dp_sum * exp_term - x / 2.0 * d;
359
360    // Check for any NaN or Inf results (can happen for extreme parameter values)
361    if !d.is_finite() || !dp.is_finite() {
362        // Fall back to direct evaluation for specific orders if series fails
363        if v.floor() == v && (-5.0..=5.0).contains(&v) {
364            return pbdv_integer(v as i32, x);
365        }
366
367        // For non-integer v that causes overflow, make a best approximation
368        let d_approx = if v < 0.0 && x.abs() > 10.0 {
369            // For large |x| and negative v, D_v(x) grows very large
370            if x > 0.0 {
371                0.0 // Approaches 0
372            } else {
373                f64::INFINITY.copysign(if v.floor() as i32 % 2 == 0 { 1.0 } else { -1.0 })
374            }
375        } else if v > 0.0 && x.abs() > 10.0 {
376            // For large |x| and positive v, D_v(x) approaches 0
377            0.0
378        } else {
379            // Other cases - use direct formula for moderate v
380            let gamma_val = gamma((1.0 + v) / 2.0);
381            2_f64.powf(-v / 2.0) * gamma_val * (-x2 / 4.0).exp()
382        };
383
384        let dp_approx = -x / 2.0 * d_approx; // Simple approximation for the derivative
385
386        return Ok((d_approx, dp_approx));
387    }
388
389    Ok((d, dp))
390}
391
392/// Asymptotic expansion for D_v(x) for large positive x with enhanced numerical stability
393#[allow(dead_code)]
394fn pbdv_asymptotic_pos(v: f64, x: f64) -> SpecialResult<(f64, f64)> {
395    // For extremely large x
396    if x > 100.0 && v > 0.0 {
397        // For large positive x and v > 0, D_v(x) approaches 0 exponentially
398        return Ok((0.0, 0.0));
399    }
400
401    // Scale to avoid overflow
402    let z = x / SQRT_2;
403    let v2 = v * v;
404
405    // Calculate the asymptotic series in log space to avoid overflow/underflow
406    let log_pre_factor = -z * z / 2.0 - (v + 0.5) * z.abs().ln() - (v / 2.0) * 2.0_f64.ln();
407
408    // Compute the sum for the asymptotic expansion
409    let mut sum = 1.0;
410    let mut term = 1.0;
411    let mut prev_sum = 0.0;
412    let mut stagnation_count = 0;
413
414    // Keep track of the derivative term
415    let mut deriv_term = 0.0;
416
417    // Extended iteration limit for better accuracy
418    for k in 1..30 {
419        // Calculate the numerator carefully to avoid overflow
420        let numerator = v2 - (2 * k - 1) as f64 * (2 * k - 1) as f64;
421        let denominator = 2.0 * k as f64 * z * z;
422
423        // Check for potential numerical issues
424        if denominator.abs() < 1e-300 {
425            // Avoid division by zero
426            break;
427        }
428
429        let term_factor = numerator / denominator;
430        let new_term = term * term_factor;
431
432        // Check for numerical stability
433        if !new_term.is_finite() {
434            // If the term would cause overflow, stop here
435            break;
436        }
437
438        term = new_term;
439        sum += term;
440
441        // Save this term for derivative calculation
442        deriv_term = term;
443
444        // Multiple convergence criteria
445
446        // Absolute tolerance
447        let abs_tol = 1e-15;
448
449        // Relative tolerance with protection against zero division
450        let rel_tol = 1e-15 * sum.abs().max(1e-300);
451
452        // First convergence check
453        if term.abs() < abs_tol || term.abs() < rel_tol {
454            break;
455        }
456
457        // Check for series stagnation
458        if (sum - prev_sum).abs() < rel_tol {
459            stagnation_count += 1;
460            if stagnation_count >= 3 {
461                break;
462            }
463        } else {
464            stagnation_count = 0;
465        }
466
467        // Check for potential divergence in the asymptotic series
468        if k > 5 && term.abs() > prev_sum.abs() {
469            // Series may be starting to diverge, use the value before divergence
470            sum = prev_sum;
471            break;
472        }
473
474        prev_sum = sum;
475    }
476
477    // Calculate function value in log space, then exponentiate
478    // Only exponentiate if it won't overflow
479    let d = if log_pre_factor < -700.0 {
480        0.0 // Underflow to zero
481    } else if log_pre_factor > 700.0 {
482        f64::INFINITY.copysign(if v.floor() as i32 % 2 == 0 { 1.0 } else { -1.0 })
483    // Overflow
484    } else {
485        log_pre_factor.exp() * sum
486    };
487
488    // Compute the derivative more carefully
489    let dp = if d.abs() < 1e-300 {
490        // For very small function values, the derivative is also near zero
491        0.0
492    } else {
493        // Derivative calculation: D_v'(x) = D_v(x) * (-z - (v+0.5)/z + correction)
494        // where correction accounts for the derivative of the sum
495        let correction = deriv_term * z / sum;
496        -d * (z + (v + 0.5) / z - correction)
497    };
498
499    // Final validation for potential numerical errors
500    if !d.is_finite() || !dp.is_finite() {
501        // For extreme cases, approximation for v >> 0 or x >> 0
502        let d_approx = 0.0; // D_v(x) → 0 for large positive x
503        let dp_approx = 0.0; // Similarly for the derivative
504        return Ok((d_approx, dp_approx));
505    }
506
507    Ok((d, dp))
508}
509
510/// Asymptotic expansion for D_v(x) for large negative x
511#[allow(dead_code)]
512fn pbdv_asymptotic_neg(v: f64, x: f64) -> SpecialResult<(f64, f64)> {
513    // For large negative x, use relationship with V_v(x)
514    let (v_val, vp_val) = pbvv(v, -x)?;
515
516    // Relationship: D_v(-x) = (sin(πv) * V_v(x) + V_{v-1}(x) / cos(πv/2)) / sin(π(v+1)/2)
517    let pi_v = PI * v;
518    let sin_pi_v = pi_v.sin();
519    let sin_pi_v_plus_1_half = (PI * (v + 1.0) / 2.0).sin();
520    let cos_pi_v_half = (PI * v / 2.0).cos();
521
522    let (v_val_prev, _) = pbvv(v - 1.0, -x)?;
523
524    let d = (sin_pi_v * v_val + v_val_prev / cos_pi_v_half) / sin_pi_v_plus_1_half;
525    let dp = -vp_val; // Derivative needs sign change due to x → -x
526
527    Ok((d, dp))
528}
529
530/// Parabolic cylinder function V_v(x) and its derivative.
531///
532/// The parabolic cylinder function V_v(x) is another solution to the differential equation:
533/// d²y/dx² + (v + 1/2 - x²/4)y = 0
534///
535/// # Arguments
536///
537/// * `v` - Order parameter
538/// * `x` - Real argument
539///
540/// # Returns
541///
542/// * A tuple containing (V_v(x), V_v'(x))
543///
544/// # Examples
545///
546/// ```
547/// use scirs2_special::pbvv;
548///
549/// let (v, vp) = pbvv(1.0, 0.5).unwrap();
550/// println!("V_1(0.5) = {}, V_1'(0.5) = {}", v, vp);
551/// ```
552#[allow(dead_code)]
553pub fn pbvv(v: f64, x: f64) -> SpecialResult<(f64, f64)> {
554    if v.is_nan() || x.is_nan() {
555        return Err(SpecialError::DomainError("NaN input to pbvv".to_string()));
556    }
557
558    // V_v can be expressed in terms of D_v for certain cases
559    if v.floor() == v && (-20.0..=20.0).contains(&v) {
560        // Integer case - can be derived from D_v
561        pbvv_integer(v as i32, x)
562    } else {
563        // General case - use series expansion or asymptotic forms
564        pbvv_general(v, x)
565    }
566}
567
568/// Implementation of V_v(x) for integer v
569#[allow(dead_code)]
570fn pbvv_integer(v: i32, x: f64) -> SpecialResult<(f64, f64)> {
571    // For integer v, V_v can be expressed in terms of D_v and D_{-v-1}
572    let (d_v, d_v_prime) = pbdv(v as f64, x)?;
573
574    if v >= 0 {
575        // For v ≥ 0
576        let (d_neg_vminus_1, d_neg_vminus_1_prime) = pbdv(-(v as f64) - 1.0, x)?;
577
578        let gamma_arg1 = v as f64 + 1.0;
579        let gamma_v_plus_1 = gamma(gamma_arg1);
580
581        // Formula: V_v(x) = D_v(x)·cos(πv) - D_{-v-1}(x)·√(2/π)·Γ(v+1)
582        let v_val =
583            d_v * (PI * v as f64).cos() - d_neg_vminus_1 * (2.0 / PI).sqrt() * gamma_v_plus_1;
584        let vp_val = d_v_prime * (PI * v as f64).cos()
585            - d_neg_vminus_1_prime * (2.0 / PI).sqrt() * gamma_v_plus_1;
586
587        Ok((v_val, vp_val))
588    } else {
589        // For v < 0
590        let (d_neg_vminus_1, d_neg_vminus_1_prime) = pbdv(-(v as f64) - 1.0, x)?;
591
592        let gamma_arg1 = -(v as f64);
593        let _gamma_neg_v = gamma(gamma_arg1);
594
595        // Formula for v < 0
596        let v_val = d_neg_vminus_1;
597        let vp_val = d_neg_vminus_1_prime;
598
599        Ok((v_val, vp_val))
600    }
601}
602
603/// General implementation of V_v(x) using series or asymptotic forms
604#[allow(dead_code)]
605fn pbvv_general(v: f64, x: f64) -> SpecialResult<(f64, f64)> {
606    // For small |x|, use series expansion
607    if x.abs() < 5.0 {
608        return pbvv_series(v, x);
609    }
610
611    // For large |x|, use asymptotic forms
612    if x.abs() > (2.0 * v.abs()).max(20.0) {
613        return pbvv_asymptotic(v, x);
614    }
615
616    // Fallback to series implementation
617    pbvv_series(v, x)
618}
619
620/// Series implementation for V_v(x) with enhanced numerical stability
621#[allow(dead_code)]
622fn pbvv_series(v: f64, x: f64) -> SpecialResult<(f64, f64)> {
623    // Special case for x = 0
624    if x == 0.0 {
625        // For x = 0, V_v(0) depends on gamma function
626        let sqrt_2_pi = (2.0 / PI).sqrt();
627        let gamma_term = gamma(v + 0.5);
628
629        // V_v(0) = sqrt(2/π) / Γ(v+1/2)
630        let v_at_zero = sqrt_2_pi / gamma_term;
631
632        // V_v'(0) depends on whether v is odd or even
633        let vp_at_zero = if v.floor() == v && v >= 0.0 {
634            if (v as i32) % 2 == 0 {
635                0.0 // Even v
636            } else {
637                // Odd v, calculate from recurrence relation
638                let mut val = sqrt_2_pi;
639                for k in 1..((v as i32 + 1) / 2) {
640                    val *= (2 * k - 1) as f64 / 2.0;
641                }
642                val
643            }
644        } else {
645            // For non-integer v, approximate
646            0.0
647        };
648
649        return Ok((v_at_zero, vp_at_zero));
650    }
651
652    // Special case for very large |x|
653    if x.abs() > 100.0 {
654        // For very large |x|, use the asymptotic form instead
655        return pbvv_asymptotic(v, x);
656    }
657
658    // For normal range of x, use enhanced series method
659    let x2 = x * x;
660
661    // Use log-based calculation for exponential to avoid overflow
662    let log_exp_term = x2 / 4.0;
663
664    // Check for potential overflow
665    let exp_term = if log_exp_term > 700.0 {
666        // For very large x², handle the exponential carefully
667        // V_v(x) grows very large for large |x|
668        f64::INFINITY
669    } else {
670        log_exp_term.exp()
671    };
672
673    // Coefficient calculation in log space for better precision
674    let sqrt_2_pi = (2.0 / PI).sqrt();
675
676    // Handle potential issues with gamma function
677    let gamma_term = if v + 0.5 > 170.0 {
678        // For large v, use logarithmic gamma
679        gammaln(v + 0.5).exp()
680    } else {
681        gamma(v + 0.5)
682    };
683
684    // Check for potential division by zero or infinity
685    let leading = if gamma_term.abs() < 1e-300 {
686        f64::INFINITY
687    } else if gamma_term.is_infinite() {
688        0.0
689    } else {
690        sqrt_2_pi * exp_term / gamma_term
691    };
692
693    // Series for V_v(x)
694    let mut v_sum; // Will be set below
695    let mut vp_sum = 0.0;
696
697    // For numerical stability, track previous sums
698    let mut prev_v_sum = 0.0;
699    let mut prev_vp_sum = 0.0;
700    let mut stagnation_count = 0;
701
702    // Initial term
703    let mut term = 1.0;
704    let mut vp_term = 0.0;
705    v_sum = term;
706
707    // Extended iteration limit for challenging cases
708    for k in 1..80 {
709        // Calculate coefficient in log space for better precision
710        let k_f64 = k as f64;
711
712        if k <= 20 {
713            // For small k, direct calculation is stable
714            let coef = (k_f64 / 2.0).powi(k / 2) / factorial(k as usize);
715
716            // Calculate x^k safely
717            let x_pow_k = x.powi(k);
718            let new_term = coef * x_pow_k;
719
720            // For derivatives, we need x^(k-1)
721            let x_pow_kminus_1 = if k > 0 { x_pow_k / x } else { 1.0 };
722            let new_vp_term = coef * x_pow_kminus_1 * k_f64;
723
724            if new_term.is_finite() {
725                term = new_term;
726                v_sum += term;
727            }
728
729            if new_vp_term.is_finite() {
730                vp_term = new_vp_term;
731                vp_sum += vp_term;
732            }
733        } else {
734            // For large k, use logarithmic calculation
735            let log_coef = (k / 2) as f64 * (k_f64 / 2.0).ln() - log_factorial(k as usize);
736            let coef = log_coef.exp();
737
738            // For x^k
739            let sign_correction = if x < 0.0 && k % 2 == 1 { -1.0 } else { 1.0 };
740            let log_x_pow_k = k_f64 * x.abs().ln();
741            let x_pow_k = sign_correction * log_x_pow_k.exp();
742
743            let new_term = coef * x_pow_k;
744
745            // For derivatives
746            let sign_correctionminus_1 = if x < 0.0 && (k - 1) % 2 == 1 {
747                -1.0
748            } else {
749                1.0
750            };
751            let log_x_pow_kminus_1 = (k_f64 - 1.0) * x.abs().ln();
752            let x_pow_kminus_1 = sign_correctionminus_1 * log_x_pow_kminus_1.exp();
753            let new_vp_term = coef * x_pow_kminus_1 * k_f64;
754
755            if new_term.is_finite() {
756                term = new_term;
757                v_sum += term;
758            }
759
760            if new_vp_term.is_finite() {
761                vp_term = new_vp_term;
762                vp_sum += vp_term;
763            }
764        }
765
766        // Multiple convergence criteria
767
768        // Absolute tolerance
769        let abs_tol = 1e-15;
770
771        // Relative tolerance with protection against zero division
772        let v_rel_tol = 1e-15 * v_sum.abs().max(1e-300);
773        let vp_rel_tol = 1e-15 * vp_sum.abs().max(1e-300);
774
775        // First check: terms becoming small
776        if (term.abs() < abs_tol || term.abs() < v_rel_tol)
777            && (vp_term.abs() < abs_tol || vp_term.abs() < vp_rel_tol)
778        {
779            break;
780        }
781
782        // Second check: sum stagnation
783        if (v_sum - prev_v_sum).abs() < v_rel_tol && (vp_sum - prev_vp_sum).abs() < vp_rel_tol {
784            stagnation_count += 1;
785            if stagnation_count >= 3 {
786                break;
787            }
788        } else {
789            stagnation_count = 0;
790        }
791
792        // Safety check for very small terms
793        if k > 50 && term.abs() < 1e-30 && vp_term.abs() < 1e-30 {
794            break;
795        }
796
797        prev_v_sum = v_sum;
798        prev_vp_sum = vp_sum;
799    }
800
801    // Final multiplication with the leading term
802    let v_val = leading * v_sum;
803
804    // Derivative calculation: V_v'(x) = V_v(x) * x/2 + derivative of series
805    let vp_val = leading * (vp_sum + v_sum * x / 2.0);
806
807    // Check for numerical issues
808    if !v_val.is_finite() || !vp_val.is_finite() {
809        // Handle extreme cases
810        if x.abs() > 20.0 {
811            // For large |x|, V_v(x) grows very rapidly
812            let sign = if x >= 0.0 { 1.0 } else { -1.0 };
813            let v_approx = sign * f64::INFINITY;
814            let vp_approx = sign * f64::INFINITY;
815            return Ok((v_approx, vp_approx));
816        } else if v > 100.0 {
817            // For large v, approximate behavior
818            let v_approx = 0.0;
819            let vp_approx = 0.0;
820            return Ok((v_approx, vp_approx));
821        }
822    }
823
824    Ok((v_val, vp_val))
825}
826
827/// Asymptotic expansion for V_v(x) with enhanced numerical stability
828#[allow(dead_code)]
829fn pbvv_asymptotic(v: f64, x: f64) -> SpecialResult<(f64, f64)> {
830    // For extremely large |x|
831    if x.abs() > 100.0 {
832        // For very large |x|, V_v(x) grows exponentially
833        let sign = if x >= 0.0 { 1.0 } else { -1.0 };
834
835        // For extremely large |x|, V_v(x) approaches sign * infinity
836        if x.abs() > 700.0 {
837            return Ok((sign * f64::INFINITY, sign * f64::INFINITY));
838        }
839    }
840
841    // Scale to avoid overflow
842    let z = x.abs() / SQRT_2;
843    let v2 = v * v;
844    let sign = if x >= 0.0 { 1.0 } else { -1.0 };
845
846    // Calculate the asymptotic series in log space to avoid overflow/underflow
847    // Compute the sum for the asymptotic expansion with enhanced stability
848    let mut sum = 1.0;
849    let mut term = 1.0;
850    let mut prev_sum = 0.0;
851    let mut stagnation_count = 0;
852
853    // Keep track of the derivative term
854    let mut deriv_term = 0.0;
855
856    // Extended iteration limit for better accuracy
857    for k in 1..30 {
858        // Calculate the numerator carefully to avoid overflow
859        let numerator = v2 - (2 * k - 1) as f64 * (2 * k - 1) as f64;
860        let denominator = 2.0 * k as f64 * z * z;
861
862        // Check for potential numerical issues
863        if denominator.abs() < 1e-300 {
864            // Avoid division by zero
865            break;
866        }
867
868        let term_factor = numerator / denominator;
869        let new_term = term * term_factor;
870
871        // Check for numerical stability
872        if !new_term.is_finite() {
873            // If the term would cause overflow, stop here
874            break;
875        }
876
877        term = new_term;
878        sum += term;
879
880        // Save this term for derivative calculation
881        deriv_term = term;
882
883        // Multiple convergence criteria
884
885        // Absolute tolerance
886        let abs_tol = 1e-15;
887
888        // Relative tolerance with protection against zero division
889        let rel_tol = 1e-15 * sum.abs().max(1e-300);
890
891        // First convergence check
892        if term.abs() < abs_tol || term.abs() < rel_tol {
893            break;
894        }
895
896        // Check for series stagnation
897        if (sum - prev_sum).abs() < rel_tol {
898            stagnation_count += 1;
899            if stagnation_count >= 3 {
900                break;
901            }
902        } else {
903            stagnation_count = 0;
904        }
905
906        // Check for potential divergence in the asymptotic series
907        if k > 5 && term.abs() > prev_sum.abs() {
908            // Series may be starting to diverge, use the value before divergence
909            sum = prev_sum;
910            break;
911        }
912
913        prev_sum = sum;
914    }
915
916    // For V_v, the leading term differs from D_v
917    let _sqrt_2_pi = (2.0 / PI).sqrt();
918
919    // Carefully handle gamma function for large v
920    let gamma_term = if v + 0.5 > 170.0 {
921        // For large v, use logarithmic gamma
922        gammaln(v + 0.5).exp()
923    } else {
924        gamma(v + 0.5)
925    };
926
927    // Calculate in log space to avoid overflow/underflow
928    // log(V_v(x)) = log(sqrt(2/π)) + log(exp(z²/2)) - log(z^(v+0.5)) + log(sum) - log(gamma_term)
929    let log_sqrt_2_pi = (2.0 / PI).sqrt().ln();
930    let log_exp_term = z * z / 2.0;
931    let log_z_term = (v + 0.5) * z.ln();
932    let log_sum = sum.ln();
933    let log_gamma = gamma_term.ln();
934
935    // Combined log calculation
936    let log_v_val = log_sqrt_2_pi + log_exp_term - log_z_term + log_sum - log_gamma;
937
938    // Only exponentiate if it won't overflow/underflow
939    let v_val = if log_v_val > 700.0 {
940        sign * f64::INFINITY
941    } else if log_v_val < -700.0 {
942        0.0
943    } else {
944        sign * log_v_val.exp()
945    };
946
947    // Enhanced derivative calculation that handles extreme cases
948    let vp_val = if !v_val.is_finite() {
949        // For infinite function values, the derivative is also infinite
950        v_val
951    } else if v_val.abs() < 1e-300 {
952        // For very small function values, the derivative is also near zero
953        0.0
954    } else {
955        // Standard derivative calculation with correction term
956        let correction = if sum.abs() < 1e-300 {
957            0.0 // Avoid division by zero
958        } else {
959            deriv_term * z / sum
960        };
961
962        v_val * (sign * z + (v + 0.5) / z - correction)
963    };
964
965    // Final validation for potential numerical errors
966    if !v_val.is_finite() && x.abs() < 100.0 {
967        // For cases where we get overflow but x isn't extremely large
968        // This can happen for some combinations of v and x
969        // Provide a reasoned approximation
970        let asymptotic_sign = if x >= 0.0 { 1.0 } else { -1.0 };
971        let v_approx = asymptotic_sign * f64::MAX * 0.1; // Large but not infinity
972        let vp_approx = v_approx; // Derivative grows at similar rate
973
974        return Ok((v_approx, vp_approx));
975    }
976
977    Ok((v_val, vp_val))
978}
979
980/// Compute a sequence of parabolic cylinder functions D_v(x) for v = 0, 1, ..., vmax.
981///
982/// # Arguments
983///
984/// * `vmax` - Maximum order (non-negative integer)
985/// * `x` - Real argument
986///
987/// # Returns
988///
989/// * A tuple of two vectors containing (D_0(x)...D_vmax(x), D_0'(x)...D_vmax'(x))
990///
991/// # Examples
992///
993/// ```
994/// use scirs2_special::pbdv_seq;
995///
996/// let (d_values, dp_values) = pbdv_seq(3, 0.5).unwrap();
997/// println!("D_0(0.5) = {}, D_1(0.5) = {}, D_2(0.5) = {}, D_3(0.5) = {}",
998///         d_values[0], d_values[1], d_values[2], d_values[3]);
999/// ```
1000#[allow(dead_code)]
1001pub fn pbdv_seq(vmax: usize, x: f64) -> SpecialResult<(Vec<f64>, Vec<f64>)> {
1002    if x.is_nan() {
1003        return Err(SpecialError::DomainError(
1004            "NaN input to pbdv_seq".to_string(),
1005        ));
1006    }
1007
1008    if vmax == 0 {
1009        let (d0, d0p) = pbdv(0.0, x)?;
1010        return Ok((vec![d0], vec![d0p]));
1011    }
1012
1013    // Initialize arrays to hold function values and derivatives
1014    let mut d_values = vec![0.0; vmax + 1];
1015    let mut dp_values = vec![0.0; vmax + 1];
1016
1017    // Compute D_0 and D_1 directly
1018    let (d0, d0p) = pbdv(0.0, x)?;
1019    let (d1, d1p) = pbdv(1.0, x)?;
1020
1021    d_values[0] = d0;
1022    dp_values[0] = d0p;
1023
1024    if vmax >= 1 {
1025        d_values[1] = d1;
1026        dp_values[1] = d1p;
1027    }
1028
1029    // Use recurrence relation to compute higher orders
1030    for v in 2..=vmax {
1031        // Recurrence relation: D_{v+1}(x) = x*D_v(x) - v*D_{v-1}(x)
1032        d_values[v] = x * d_values[v - 1] - (v as f64 - 1.0) * d_values[v - 2];
1033        // Derivative recurrence: D'_{v+1}(x) = x*D'_v(x) - v*D'_{v-1}(x) + D_v(x)
1034        dp_values[v] = x * dp_values[v - 1] - (v as f64 - 1.0) * dp_values[v - 2] + d_values[v - 1];
1035    }
1036
1037    Ok((d_values, dp_values))
1038}
1039
1040/// Compute a sequence of parabolic cylinder functions V_v(x) for v = 0, 1, ..., vmax.
1041///
1042/// # Arguments
1043///
1044/// * `vmax` - Maximum order (non-negative integer)
1045/// * `x` - Real argument
1046///
1047/// # Returns
1048///
1049/// * A tuple of two vectors containing (V_0(x)...V_vmax(x), V_0'(x)...V_vmax'(x))
1050///
1051/// # Examples
1052///
1053/// ```
1054/// use scirs2_special::pbvv_seq;
1055///
1056/// let (v_values, vp_values) = pbvv_seq(3, 0.5).unwrap();
1057/// println!("V_0(0.5) = {}, V_1(0.5) = {}, V_2(0.5) = {}, V_3(0.5) = {}",
1058///         v_values[0], v_values[1], v_values[2], v_values[3]);
1059/// ```
1060#[allow(dead_code)]
1061pub fn pbvv_seq(vmax: usize, x: f64) -> SpecialResult<(Vec<f64>, Vec<f64>)> {
1062    if x.is_nan() {
1063        return Err(SpecialError::DomainError(
1064            "NaN input to pbvv_seq".to_string(),
1065        ));
1066    }
1067
1068    // Initialize arrays to hold function values and derivatives
1069    let mut v_values = vec![0.0; vmax + 1];
1070    let mut vp_values = vec![0.0; vmax + 1];
1071
1072    // Compute each V_v individually - this can be optimized further
1073    for v in 0..=vmax {
1074        let (v_val, vp_val) = pbvv(v as f64, x)?;
1075        v_values[v] = v_val;
1076        vp_values[v] = vp_val;
1077    }
1078
1079    Ok((v_values, vp_values))
1080}
1081
1082/// Compute parabolic cylinder function W(a,x) and its derivative.
1083///
1084/// The function W(a,x) is related to the parabolic cylinder functions
1085/// D_v(x) and satisfies the differential equation:
1086/// d²W/dx² + (a - x²/4)W = 0
1087///
1088/// # Arguments
1089///
1090/// * `a` - Parameter
1091/// * `x` - Real argument
1092///
1093/// # Returns
1094///
1095/// * A tuple containing (W(a,x), W'(a,x))
1096///
1097/// # Examples
1098///
1099/// ```
1100/// use scirs2_special::pbwa;
1101///
1102/// let (w, wp) = pbwa(1.0, 0.5).unwrap();
1103/// println!("W(1.0, 0.5) = {}, W'(1.0, 0.5) = {}", w, wp);
1104/// ```
1105#[allow(dead_code)]
1106pub fn pbwa(a: f64, x: f64) -> SpecialResult<(f64, f64)> {
1107    if a.is_nan() || x.is_nan() {
1108        return Err(SpecialError::DomainError("NaN input to pbwa".to_string()));
1109    }
1110
1111    // W(a,x) is related to D_v(x) by: W(a,x) = D_{-a-1/2}(x)
1112    let v = -a - 0.5;
1113    pbdv(v, x)
1114}
1115
1116// Helper function to calculate factorial with overflow protection
1117#[allow(dead_code)]
1118fn factorial(n: usize) -> f64 {
1119    if n <= 1 {
1120        return 1.0;
1121    }
1122
1123    // For small values, direct computation is fine
1124    if n <= 20 {
1125        let mut result = 1.0;
1126        for i in 2..=n {
1127            result *= i as f64;
1128        }
1129        return result;
1130    }
1131
1132    // For larger values, use the logarithmic approach to avoid overflow
1133    // Switch to gammaln for large factorials, since n! = Γ(n+1)
1134    let result = gammaln(n as f64 + 1.0).exp();
1135
1136    // Check if the result is finite
1137    if result.is_finite() {
1138        result
1139    } else {
1140        // For extremely large n that would overflow even with gammaln,
1141        // use Stirling's approximation: n! ≈ sqrt(2πn) * (n/e)^n
1142        let n_f64 = n as f64;
1143        (2.0 * PI * n_f64).sqrt() * (n_f64 / std::f64::consts::E).powf(n_f64)
1144    }
1145}
1146
1147// Helper function to approximate error function with improved accuracy and stability
1148#[allow(dead_code)]
1149fn erf_approx(x: f64) -> f64 {
1150    // Special cases
1151    if x == 0.0 {
1152        return 0.0;
1153    }
1154
1155    if !x.is_finite() {
1156        return if x.is_sign_positive() { 1.0 } else { -1.0 };
1157    }
1158
1159    // Extremely large values of |x|
1160    if x.abs() > 6.0 {
1161        return if x > 0.0 { 1.0 } else { -1.0 };
1162    }
1163
1164    // A more accurate approximation based on Abramowitz and Stegun (1964)
1165    // with optimized parameters for floating-point arithmetic stability
1166    if x.abs() <= 0.5 {
1167        // Use Taylor series expansion for small |x|
1168        // erf(x) ≈ (2/sqrt(π)) * x * (1 - x²/3 + x⁴/10 - x⁶/42 + x⁸/216 - ...)
1169        let x2 = x * x;
1170        let x4 = x2 * x2;
1171        let x6 = x4 * x2;
1172        let x8 = x4 * x4;
1173
1174        let two_over_sqrt_pi = 2.0 / PI.sqrt();
1175
1176        x * two_over_sqrt_pi * (1.0 - x2 / 3.0 + x4 / 10.0 - x6 / 42.0 + x8 / 216.0)
1177    } else {
1178        // For larger |x|, use the approximation from Numerical Recipes
1179        let z = x.abs();
1180        let t = 1.0 / (1.0 + 0.5 * z);
1181
1182        // More accurate coefficients for better stability
1183        let tau = t
1184            * (-z * z - 1.26551223
1185                + t * (1.00002368
1186                    + t * (0.37409196
1187                        + t * (0.09678418
1188                            + t * (-0.18628806
1189                                + t * (0.27886807
1190                                    + t * (-1.13520398
1191                                        + t * (1.48851587
1192                                            + t * (-0.82215223 + t * 0.17087277)))))))));
1193
1194        let result = if x >= 0.0 { 1.0 - tau } else { tau - 1.0 };
1195
1196        // Check for underflow or near-zero values
1197        if result.abs() < 1e-16 {
1198            if x >= 0.0 {
1199                1.0
1200            } else {
1201                -1.0
1202            }
1203        } else {
1204            result
1205        }
1206    }
1207}
1208
1209// Log factorial function for use with very large factorials
1210#[allow(dead_code)]
1211fn log_factorial(n: usize) -> f64 {
1212    if n <= 1 {
1213        return 0.0; // log(1) = 0
1214    }
1215
1216    // Use gammaln for log(n!)
1217    gammaln(n as f64 + 1.0)
1218}