1942 J. Opt. Soc. Am. A / Vol. 21, No. 10 / October 2004 Yang et al. Revised Kubelka–Munk theory. II. Unified framework for homogeneous and inhomogeneous optical media Li Yang, Björn Kruse, and Stanley J. Miklavcic Campus Norrköping (ITN), Linköping University, S-601 74, Norrköping, Sweden Received January 15, 2004; revised manuscript accepted April 14, 2004; accepted May 5, 2004 We extend the applicability of the recently revised Kubelka–Munk (K–M) theory to inhomogeneous optical media by treating inhomogeneous ink penetration of the substrate. We propose a method for describing light propagation in either homogeneous or inhomogeneous layers using series representations for the K–M scattering and absorption coefficients as well as for intensities of the upward and downward light streams. The conventional and matrix expressions for spectral reflectance and transmittance values of optically homogeneous media in the K–M theory are shown to be special cases of the present framework. Three types of ink distribution—homogeneous, linear, and exponential—have been studied. Simulations of spectral reflectance predict a depression of reflectance peaks and reduction of absorption bands characteristic of hue shifts and significant reduction of saturation and, in turn, color gamut. © 2004 Optical Society of America OCIS codes: 000.3860, 120.5700, 120.7000, 290.7050. 1. INTRODUCTION The original theory of Kubelka–Munk (K–M) was developed for light propagation in parallel colorant layers of infinite extension in the xy plane.1,2 The fundamental assumptions of the K–M theory were that the layer was homogeneous and that the light distribution inside the layer was completely diffuse. From these assumptions, light propagation in the layer was simply represented by two diffuse light fluxes through the layer, one upward, the other simultaneously downward. After its introduction in the 1930s the K–M theory was extended by removing some of the original assumptions. Among others, a correction for boundary reflection at the interface between two adjacent media was introduced by Saunderson,3 i.e., the so-called Saunderson correction. Kubelka himself also made an attempt to extend the applicability of the theory to optically inhomogeneous samples.4 However, this extension was applicable only to the special case of inhomogeneous media in which the ratio of the absorption to the scattering was constant. A more generalized approach based on regular perturbation theory for inhomogeneous optical media was proposed by Mandelis and Grossman.5 With this model, they computed the reflectance and transmittance of media layers with an exponential inhomogeneity. The present work reflects the continuing efforts toward improving matters by extending the applicability of the revised K–M theory of part I of this paper6 to inhomogeneous media systems, as occurs for instance with an inhomogeneous ink distribution in a paper substrate incident to ink distribution in paper. This work necessarily complements the work of Mandelis and Grossman as the dependence of the K–M scattering and absorption coefficients S and K on the ink distribution (z) is more complicated than in the original theory. Consequently, special care has been taken in the derivation of formulas to 1084-7529/2004/101942-11$15.00 ease numerical implementation. Moreover, the present work provides a unified framework for modeling either homogeneous or inhomogeneous media distributions. This paper consists of five main sections. Section 2 provides a brief description of the revised K–M theory together with a collection of boundary conditions. Expressions for the spectral reflectance and transmittance of a media layer having arbitrary types of media distribution, with or without backing, are derived in Section 3. Section 4 describes examples of three types of ink penetration: homogeneous, linear, and exponential. Section 5 consists of simulations and discussions. In Section 6 we summarize our results. 2. DIFFERENTIAL EQUATIONS AND BOUNDARY CONDITIONS Figure 1 is a schematic diagram of ink penetration of paper in which the ink penetration begins from the surface of the substrate at z ⫽ D and ends at z ⫽ 0. In the case of inhomogeneous ink dispersion, the intrinsic scattering and absorption coefficients of the ink–paper mixture are functions of the depth of ink penetration z; i.e., s ⫽ s(z) and a ⫽ a(z), depending on the distribution of ink concentration. Consequently, the K–M scattering and absorption coefficients S and K of the ink–paper mixture in the differential equations dI dz dJ dz ⫽ 共 S ⫹ K 兲 I ⫺ SJ, ⫽ ⫺共 S ⫹ K 兲 J ⫹ SI (1) are also z-dependent, because K 共 z 兲 ⫽ ␣ a, © 2004 Optical Society of America S 共 z 兲 ⫽ ␣ s/2. (2) Yang et al. Vol. 21, No. 10 / October 2004 / J. Opt. Soc. Am. A Fig. 1. Schematic diagram of a linear ink distribution (with backing). Ink penetration begins from the surface of the substrate at z ⫽ D and ends at z ⫽ 0. The remaining part of the paper sheet (below z ⫽ 0) acts as a backing for the inked part. In Eqs. (2) is the scattering-induced-path-variation (SIPV) factor, which depends on the relative strength between scattering and absorption, i.e., 共 z 兲 ⫽ 再 关 s 共 z 兲 /a 共 z 兲兴 1, 1/2 s共 z 兲 ⭓ a共 z 兲 otherwise , (3) while ␣ is a factor describing light distribution in the mixture and is defined by Eq. (16) in part I.6 The main task of this paper is then to solve the differential equations with S ⫽ S(z) and K ⫽ K(z). The layer of the ink–paper mixture shown in Fig. 1 interfaces with air and the remainder of the paper sheet at z ⫽ D and z ⫽ 0; respectively. Assuming that the layer is in optical contact with the remainder of the paper with a backing of reflectance R g at z ⫽ 0, one obtains J a共 0 兲 ⫽ I a共 0 兲 R g . (4) If the external and internal surface reflections at the z ⫽ D interface are r 0 and r 1 , respectively, as shown in the figure, one may then deduce the following boundary conditions at the z ⫽ D interface7: I b共 D 兲 ⫽ I 0共 1 ⫺ r 0 兲 ⫹ J b共 D 兲 r 1 , I a 共 D 兲 R ⫽ I a 共 D 兲 r 0 ⫹ J b 共 D 兲共 1 ⫺ r 1 兲 , Figure 1 shows schematically the extent of ink penetration into a paper sheet. Let Z ⫽ z/D and let D denote the thickness of the ink-penetrated layer extending to the point where the ink concentration is essentially zero. Then the ink penetration begins from the upper surface of the paper sheet Z ⫽ 1 or z ⫽ D and ends at Z ⫽ 0. The remaining part of the sheet remains clear, forming a background for the ink-penetrated part. Except in the case of a complete print-through, the ink penetrates only partially into the paper sheet. Here the thickness D will be only a fraction of the total paper thickness. Suppose that the ink distribution as described by the ink density relative to that of a printed ink layer that does not mix with paper fibers (caused by ink penetration) varies only in the z direction, i.e., 共 Z 兲 ⫽ z D 共 0 ⬍ z ⭐ D 兲. , (6) A. K–M Scattering and Absorption Coefficients Suppose the K–M coefficients of absorption and scattering are K p , S p and K i , S i for paper and ink, respectively. By measuring the spectral reflectance properties of a piece of paper against a black and a white backing, one obtains two sets of experimental spectral reflectance values. K p and S p can then be computed by employing the K–M theory. Similarly, one obtains another two sets of spectral reflectance values by measuring the once and twice printed ink layers on overhead-projector film (with a white backing9). According to Eq. (2) the scattering and absorption coefficients of the ink s i , a i and the paper a p , s p can be computed by a i ⫽ K i / i␣ i , s i ⫽ 2S i / i ␣ i , a p ⫽ K p / p␣ p , s p ⫽ 2S p / p ␣ p , where i共 兲 ⫽ 3. SERIES SOLUTION OF THE DIFFERENTIAL EQUATIONS For inkjet printing, the absorption of ink constituents by a paper medium is driven by the thermodynamic interaction between the ink and the paper, manifested by capillary forces and chemical diffusion gradients. Capillary pressure is acknowledged to be the main driving force in the offset-ink-oil transport in a typical porous papercoating structure. However, with increasing latex content, the diffusion-driven transport of ink chemicals into the latex counterpart of the coating layer becomes important.8 The different mechanisms driving ink penetration result in different forms of ink distribution in the paper. Coping with this degree of variation demands a framework that can deal with any form of ink distribution in a unified manner. 冉冊 The form taken by the ink distribution in the paper depends on the rheological properties of the ink, the surface and bulk properties of the paper, and their interactions. (5) where R is the reflectance of the medium. In Eqs. (4) and (5) the subscripts a and b denote the corresponding values (a) above and (b) below the interface. Therefore I a (D) ⫽ I 0 , as shown in the figure. 1943 再冋 2S i 共 兲 K i共 兲 册 1/2 , 1, and p共 兲 ⫽ 再冋 2S p 共 兲 K p共 兲 1, 2S i 共 兲 ⭓ K i 共 兲 otherwise 册 1/2 , 2S p 共 兲 ⭓ K p 共 兲 otherwise are the SIPV factors of the ink and the paper, respectively. In the case of ink penetration, the ink penetrates into the porous structure of the paper, forming an ink–paper mixture. The tiny size of the dye molecules and the relatively small amount of dye present suggest that the structure of the paper remains the same after printing. 1944 J. Opt. Soc. Am. A / Vol. 21, No. 10 / October 2004 Yang et al. Applying the additivity law, the absorption and scattering coefficients of the ink–paper composite a ip , s ip can then be expressed as ip 共 兲 ⫽ a ip ⫽ a p ⫹ 共 Z 兲 a i , 冦 冋 2h 共 S p 共 兲 , S i 共 兲 , Z 兲 h 共 K p共 兲 , K i共 兲 , Z 兲 册 1/2 , 2h 共 S p , S i , Z 兲 ⬎ h 共 K p , K i , Z 兲 1, . otherwise s ip ⫽ s p ⫹ 共 Z 兲 s i , where (Z) is the ink concentration relative to that of the pure ink layer. The SIPV factor of the ink–paper mixture is then computed by6 ip 共 兲 ⫽ 再冋 s p共 兲 ⫹ 共 Z 兲 s i共 兲 a p共 兲 ⫹ 共 Z 兲 a i共 兲 册 Consequently, the K–M scattering and absorption coefficients for the ink–paper mixture can be expressed completely in terms of its components, i.e., 1/2 s ip 共 兲 ⬎ a ip 共 兲 , 1, . otherwise K ip 共 兲 ⫽ Clearly, the SIPV in the ink–paper mixture depends on the ink concentration (Z). According to Eq. (2), the K–M scattering and absorption coefficients are then K ip 共 Z 兲 ⫽ ip ␣ ip a ip ⫽ ip ␣ ip p ␣p Kp ⫹ 共 Z 兲 ip ␣ ip i ␣i S ip 共 兲 ⫽ Ki ⫽ ip h 共 K p , K i , Z 兲 , (7) 冦 关 2h 共 S p , S i , Z 兲 h 共 K p , K i , Z 兲兴 1/2, 冦 2h 2 共 S p , S i , Z 兲 /K ip , 2h 共 S p , S i , Z 兲 ⬎ h共 Kp , Ki , Z 兲 h共 Kp , Ki , Z 兲, (10) . (11) otherwise 2h 共 S p , S i , Z 兲 ⬎ h共 Kp , Ki , Z 兲 h共 Sp , Si , Z 兲, , otherwise S ip 共 Z 兲 ⫽ ip ␣ ip s ip /2 ⫽ ip ␣ ip p ␣p Sp ⫹ 共 Z 兲 ip ␣ ip i ␣i Si ⫽ ip h 共 S p , S i , Z 兲 , (8) where h 共 x, y, Z 兲 ⫽ 1 ␣ ip p ␣p x⫹ 共 Z 兲 ␣ ip i ␣i y, (9) with x ⫽ S p , K p and y ⫽ S i , K i . ␣ i , ␣ p , and ␣ ip are quantities related to the light distribution in the ink, the paper, and the ink–paper mixture, respectively. Similarly i , p , and ip are the SIPV factors of the ink, the paper, and the ink–paper mixture, respectively. These quantities are generally different for the different media (ink, paper, and ink–paper) because of different scattering and absorption properties. Equations (7) and (8) are expressions describing the relationships between the K–M scattering and absorption coefficients for the ink– paper mixture and those of the ink and paper. The additivity results advocated in earlier publications7,10 hold only in an extreme, special case: When ip ⫽ p ⫽ i and ␣ ip ⫽ ␣ p ⫽ ␣ i . Since s ip /a ip ⫽ 2S ip /K ip ⫽ 2h 共 S p , S i , Z 兲 /h 共 K p , K i , Z 兲 , the SIPV factor ip can be expressed as The dependencies of the K–M scattering and absorption coefficients for the ink–paper mixture, K ip , S ip on the form of the ink penetration are generally nonlinear as indicated by Eqs. (10) and (11), unless s ip ⬍ a ip and ip ⫽ 1. This is in sharp contrast to previous theoretical predictions based on the original K–M theory stating that K ip and S ip are linear superpositions of the K–M coefficients of ink and paper K i , K p and S i , S p , respectively.10–12 For simplicity we denote the K–M absorption and scattering coefficients for the ink–paper mixture as functions f and g of the Z coordinate: f 共 Z 兲 ⫽ K ip 共 兲 ⫽ 冦 关 2h 共 S p , S i , Z 兲 h 共 K p , K i , Z 兲兴 1/2, 2h 共 S p , S i , Z 兲 ⬎ h共 Kp , Ki , Z 兲 h共 Kp , Ki , Z 兲, , (12) . (13) otherwise g 共 Z 兲 ⫽ S ip 共 兲 ⫽ 冦 2h 2 共 S p , S i , Z 兲 /K ip , 2h 共 S p , S i , Z 兲 ⬎ h共 Kp , Ki , Z 兲 h共 Sp , Si , Z 兲, otherwise Yang et al. Vol. 21, No. 10 / October 2004 / J. Opt. Soc. Am. A Here it is convenient to expand the K–M absorption f(Z) and scattering g(Z) coefficients in Taylor series in the vicinity of Z ⫽ 0, i.e., 1 f共 Z 兲 ⫽ f共 0 兲 ⫹ ¯ ⫹ n! 1 ⬁ ⬁ 兺 nb n Z D n⫽1 n! ⫹ f 共 n 兲共 0 兲 Z n ⫹ ¯ (14) with f (x) as the nth-order derivative of f(x). In an exactly analogous manner one obtains 1 g 共 m 兲共 0 兲 Z m ⫹ ¯ ⫽ 0 共 0 兲 ⫹ ¯ ⫹ m 共 0 兲 Z m ⫹ ¯, (15) where 1 m共 0 兲 ⫽ m! g 共 m 兲共 0 兲 , with g ( m ) (x) as the mth-order derivative of g(x). Consequently, the scattering and absorption coefficients of the medium layer can be expressed as ⬁ 兺 Z, K ip 共 Z 兲 ⫽ l l (16a) bn ⫽ D 兺 (16b) l⫽0 B. Reflectance of a Media Layer Generally speaking, the differential Eqs. (1) have no known closed-form solutions, except in a few special cases. Assuming, however, that any existing solutions are analytic functions of Z, we can express them in series form too, as ⬁ I⫽ 兺 l a m Z l⫹m . n D n 冋兺 冋兺 共 l ⫹ l 兲 a n⫺l⫺1 ⫺ l⫽0 n⫺1 共 l ⫹ l 兲 b n⫺l⫺1 ⫹ l⫽0 兺 D n⫽1 ⬁ na n Z n⫺1 ⫽ b mZ m. (17) ⬁ 兺兺 共 l ⫹ l 兲 a m Z l⫹m l⫽0 m⫽0 ⬁ ⫺ ⬁ 兺兺 l⫽0 m⫽0 册 l a n⫺l⫺1 . l⫽0 (21) These recurrence relations reveal two noteworthy features. First, there are only two undetermined coefficients, say a 0 and b 0 . All other coefficients, a n or bn for n ⭓ 1, are functions of these. This is consistent with the original 2 ⫻ 2 differential system. Second, both coefficients a n and bn are proportional to a n⫺1 /n and b n⫺1 /n, which generally leads to sufficiently fast convergence of the series expansions. Moreover, this last feature provides us with the possibility of truncating the series expansions at a certain finite order. Since the variable 0 ⭐ Z ⬍ 1 is independent of the range of ink penetration, Eqs. (20) and (21) allow us to draw meaningful conclusions. Imposing the boundary condition at Z ⫽ 0 [Eq. (4)] gives (22) The remaining undetermined coefficient, say a 0 , can be determined by applying the boundary condition at the Z ⫽ 1 interface. Inserting Eq. (16) into the boundary at Z ⫽ 1 [Eq. (5)], gives ⬁ 兺 ⬁ a n ⫽ I 0共 1 ⫺ r 0 兲 ⫹ r 1 n⫽0 兺 bn , n⫽1 ⬁ I 0R ⫽ I 0r 0 ⫹ 共 1 ⫺ r 1 兲 兺 bn . (23) n⫽0 兺 These, together with Eqs. (16), can be inserted into the differential equations to get the following algebraic system of equations: ⬁ 兺 ⬁ m⫽0 1 l b n⫺l⫺1 , (20) l⫽0 The reflectance of the system is then obtained as a nZ n, ⬁ 兺 兺 n⫺1 ⫺ 册 n⫺1 n⫽0 J⫽ (19) b 0 ⫽ R ga 0 . ⬁ lZ l. 兺兺 n⫺1 l⫽0 S ip 共 Z 兲 ⫽ ⬁ By identifying the coefficients of Z n on both sides of the equations one obtains, for n ⭓ 1, an ⫽ f 共 n 兲共 0 兲 , m! 共 l ⫹ l 兲 b m Z l⫹m l⫽0 m⫽0 (n) g共 Z 兲 ⫽ g共 0 兲 ⫹ ¯ ⫹ 兺兺 l⫽0 m⫽0 where 1 ⫽⫺ ⬁ ⬁ ⫽ 0 共 0 兲 ⫹ ¯ ⫹ n 共 0 兲 Z n ⫹ ¯, n共 0 兲 ⫽ n⫺1 1945 l b m Z l⫹m , (18) R ⫽ r 0 ⫹ 共 1 ⫺ r 0 兲共 1 ⫺ r 1 兲 bm m⫽0 . (24) ⬁ 兺 共 a m ⫺ b mr 1 兲 m⫽0 Since all the a n and b n are proportional to a 0 , the fraction in Eq. (24) is independent of a 0 . Thus one can compute the reflectance simply by setting a 0 to an arbitrary value (say, a 0 ⫽ 1). C. Transmittance of a Freely Suspended Media Layer When the media layer is freely suspended as shown in Fig. 2, the boundary condition at Z ⫽ 0 [Eq. (22)] should be replaced by 1946 J. Opt. Soc. Am. A / Vol. 21, No. 10 / October 2004 Yang et al. ⫽ Fig. 2. Schematic diagram of a linear ink distribution in a freely suspended layer. Ink penetration begins from the surface of the substrate at z ⫽ D and ends at z ⫽ 0. b 0 ⬇ r 2a 0 , where r 2 is the internal surface reflection at the lower interface. Even though the remaining expansion coefficients (a n , b n , n ⭓ 1) change with a 0 and b 0 , the expression for the reflectance at Z ⫽ 1 given in Eq. (24) remains unchanged. It is important to note that the internal boundary reflection at the upper interface r 1 may be different from that of the lower interface r 2 in the case of an inhomogeneous ink distribution. By combining the boundary conditions at Z ⫽ 1 [Eq. (23)] with the condition at Z ⫽ 0, I 0T ⫽ a 0共 1 ⫺ r 2 兲 , an expression for the transmittance of light through the freely suspended layer T can be determined as 冒兺 ⬁ T ⫽ a 0 共 1 ⫺ r 0 兲共 1 ⫺ r 2 兲 共 a m ⫺ b mr 1 兲. (25) m⫽0 Although a 0 explicitly appears in this expression, T is, interestingly enough, actually independent of a 0 , again because the a m and b m in the denominator are proportional to a 0 as we have previously indicated. D. Remarks In the case of an inhomogeneous ink distribution, the expressions for S ip and K ip given in Eqs. (10) and (11) may change form depending on whether the inequality 2h(S p , S i , Z) ⭐ h(K p , K i , Z) is satisfied. Suppose the transition occurs at a certain depth ⭐ 1 determined by 共 兲 ⫽ i ␣ i 共 2S p ⫺ K p 兲 p ␣ p 共 K i ⫺ 2S i 兲 . 1 i ␣ i 共 2S p ⫺ K p 兲 1 p ␣ p 共 K i ⫺ 2S i 兲 . Computed transition depths for the primary colors are depicted in Fig. 3, which reveals a distinct dependence on inks and spectra. This dependence is reasonable since the transition occurs only in the absorption bands of these colors. Moreover, the closer to the center of the absorption band, the lower the . The vertical or nearly vertical curves in the figure indicate that the value changes sign in the vicinity of the wavelengths corresponding to a sign change in K i ⫺ 2S i . For example, for cyan ink (solid curve) and at ⬇ 430 nm, changes sign as a result of decreasing absorption approaching the transparent band. again changes sign at ⬇ 540 nm approaching the absorption band of cyan. After determining the transition depth for each color and at each wavelength, the overall spectral reflectance of the ink–paper composite can be calculated sublayer by sublayer by repeatedly applying the theory developed above. In each sublayer one needs only to redefine the z coordinate as z ⫽ 0 and z ⫽ D corresponding to the bottom and top surfaces of a sublayer, respectively. For example, one can first compute the reflectance R 1 of the lower sublayer. If we replace 1 with 1 , all equations derived in Subsections 3.B. and 3.C. are immediately applicable. Then by considering all the medium below as a backing for the upper sublayer with reflectance R 1 , namely, by replacing R g with R 1 in Eq. (22), we can compute the overall spectral reflectance of the entire ink– paper mixture in exactly the same manner. These issues are further illustrated in Subsections 4.B. and 4.C. below with examples of linear and exponential ink distributions. Similar operations apply even for transmittance. Given that the transmittances of the lower and upper sublayers are T 1 and T 2 , respectively, the overall transmittance of the entire ink–paper mixture is T ⫽ T 1 T 2 , provided the boundary reflection at the transition surface is negligible. Clearly, such a stepwise strategy works even for a nonmonotonic ink distribution or, equivalently, for a multilayer media system. (26) In such a case, one can divide the ink–paper layer into two sublayers with transition surface at . Within each sublayer, S ip or K ip then has the same functional form. Since 苸 (0, 1), a value outside this range implies no transition. For a monotonic ink distribution Eq. (26) has at most one solution satisfying 苸 (0, 1). For a linear ink distribution, for example, 共 Z 兲 ⫽ 1 Z, one obtains (27) Fig. 3. Spectral dependence of depths for status transition of primary colors (linear ink distribution). Yang et al. Vol. 21, No. 10 / October 2004 / J. Opt. Soc. Am. A 4. EXAMPLES OF HOMOGENEOUS AND INHOMOGENEOUS MEDIUM LAYERS Equations (24) and (25) are general expressions giving the reflectance and transmittance values for a medium of arbitrary material distribution. Different distributions lead to different recurrence relations Eqs. (20) and (21) for the set of coefficients 兵 a n , b n 其 , which in turn describe the different reflectance and transmittance properties. To highlight the flexibility and utility of the solutions, we shall apply the analysis to medium layers of both homogeneous and inhomogeneous ink distributions. In the case of a homogeneous ink distribution, we focus on establishing connections between the present framework and previous studies in the form of analytical solutions of the K–M theory in both conventional and matrix forms.2,4,13,14 As examples of inhomogeneous ink distribution, both linear and exponential ink distributions are studied. Since the matrix elements are constants, we can utilize the definition of the exponential of a matrix to give 冋 册 ⬁ 兺 an n⫽0 ⬁ 兺 ⫽ exp bn ⫽ p p x⫹ 1 ␣ ip i ␣i y is independent of Z. The coefficients (expanded in the vicinity of Z ⫽ 0) that apply in Eqs. (14) and (15) are then K ⫽ 0 ⫽ 再 S ⫽ 0 ⫽ 再 otherwise 兺 an , 兺 bn , R bulk ⫽ 共 n ⭓ 1 兲. , , and Correspondingly, Eqs. (20) and (21) become simply n (28) Eq. (28) is essentially the matrix expression for the solutions to the K–M differential equations (at z ⫽ D or Z ⫽ 1) introduced by Emmel and Hersch.13,15 By applying the boundary condition at Z ⫽ 0 [Eq. (4)], we can compute the bulk reflectance of a homogeneous medium (with backing R g ) by13,15 h 共 S p , S i , 1兲 , D a0 . w b0 J共 Z ⫽ 1 兲 ⫽ 2h 共 S p , S i , 1兲 ⬎ h 共 K p , K i , 1兲 bn ⫽ v u ⬁ 2h 2 共 S p , S i , 1兲 / 0 , n a0 b0 n⫽0 otherwise an ⫽ t I共 Z ⫽ 1 兲 ⫽ h 共 K p , K i , 1兲 , D ⫺ 共K ⫹ S兲 D ⬁ 2h 共 S p , S i , 1兲 ⬎ h 共 K p , K i , 1兲 n ⫽ 0 S 册 冎冋 册 Considering that 关 2h 共 S p , S i , 1兲 h 共 K p , K i , 1兲兴 1/2, n ⫽ 0, ⫺S n⫽0 Consequently, the function h 共 x, y, Z 兲 ⫽ 共K ⫹ S兲 冋 册冋 册 共 0 ⬍ Z ⭐ 1 兲. 1 ␣ ip 再冋 n⫽0 A. Homogeneous Ink Penetration For the homogeneous ink penetration, one has 共 Z 兲 ⫽ 1 , 1947 ⫽ 关共 K ⫹ S 兲 a n⫺1 ⫺ Sb n⫺1 兴 , v ⫹ R gw t ⫹ R gu 共 R ⬁ ⫺ R g 兲 exp共 ⫺2bSD 兲 ⫺ R ⬁ 共 1 ⫺ R ⬁ R g 兲 R ⬁ 共 R ⬁ ⫺ R g 兲 exp共 ⫺2bSD 兲 ⫺ 共 1 ⫺ R ⬁ R g 兲 , (29) 关 ⫺共 K ⫹ S 兲 b n⫺1 ⫹ Sa n⫺1 兴 . where It is convenient to rewrite these in matrix form, i.e., 冋 册 冋 D 共K ⫹ S兲 an ⫽ bn S n ⫺S 册冋 册 a n⫺1 . ⫺ 共 K ⫹ S 兲 b n⫺1 By repeatedly applying the recurrence relation, one obtains 冋 册 冋 Dn 共K ⫹ S兲 an ⫽ bn S n! ⫺S ⫺ 共K ⫹ S兲 册冋 册 n a0 . b0 R ⬁ ⫽ 1 ⫹ K/S ⫺ 共 K 2 /S 2 ⫹ 2K/S 兲 1/2, b ⫽ 共 1 ⫺ R ⬁ 2 兲 /2R ⬁ . According to Eq. (24), the total reflection of the ink layer, including the top surface reflection, can therefore be written as 1948 J. Opt. Soc. Am. A / Vol. 21, No. 10 / October 2004 R ⫽ r 0 ⫹ 共 1 ⫺ r 0 兲共 1 ⫺ r 1 兲 Yang et al. R bulk 1 ⫺ r 1 R bulk ⫽ r 0 ⫹ 共 1 ⫺ r 0 兲共 1 ⫺ r 1 兲 ⫻ 共 R ⬁ ⫺ R g 兲 exp共 ⫺2bSD 兲 ⫺ R ⬁ 共 1 ⫺ R ⬁ R g 兲 共 R ⬁ ⫺ r 1 兲共 R ⬁ ⫺ R g 兲 exp共 ⫺2bSD 兲 ⫺ 共 1 ⫺ R ⬁ r 1 兲共 1 ⫺ R ⬁ R g 兲 . 1 ⫽ 关 h 共 K p , K i , 0兲 h ⬘ 共 S p , S i , 0兲 Equation (30) is exactly the analytical solution of the K–M theory for a homogeneous material distribution.16 Similarly, Eq. (25) becomes ⫹ h ⬘ 共 K p , K i , 0兲 h 共 S p , S i , 0兲兴 / 0 , 1 ⫽ 关 4h 共 S p , S i , 0兲 h ⬘ 共 S p , S i , 0兲 T ⫽ 共 1 ⫺ r 0 兲共 1 ⫺ r 1 兲 ⫻ ⫺ 0 1兴 / 0 , 共 1 ⫺ R ⬁ 2 兲 exp共 ⫺bSD 兲 共 1 ⫺ R ⬁ r 1 兲 2 ⫺ 共 R ⬁ ⫺ r 1 兲 2 exp共 ⫺2bSD 兲 . and for n ⭓ 1 there are Therefore, the conventional [Eqs. (30) and (31)] and matrix expressions of the K–M solutions for the homogeneous ink distribution derived previously are only special cases of the present framework. B. Linear Ink Penetration To cope with the possibility that there exists a transition for the inequality 2h(S p , S i , Z) ⭐ h(K p , K i , Z) at Z ⫽ (see Subsection 3.D.), the expression for a linear ink distribution given in Eq. (27) is modified to 共 Z兲 ⫽ CZ ⫹ 0 , 共0 ⬍ Z ⬍ 兲 共 Z ⫺ 兲/共 1 ⫺ 兲, 共 ⬍ Z ⬍ 1兲 . Thus Z ⫽ 0 and 1 correspond to the bottom and top surfaces in each sublayer. In the sublayer below the transition surface (Z ⫽ ), 0 ⫽ 0 and C ⫽ 1 , while in the sublayer above the transition surface, 0 ⫽ 1 and C ⫽ 1 (1 ⫺ ). Therefore 1 ␣ ip p ␣p x⫹ CZ ⫹ 0 ␣ ip i ␣i y. For Z satisfying 2h(S p , S i , Z) ⭐ h(K p , K i , Z) the Taylor expansion coefficients (expanded in the vicinity of Z ⫽ 0) are 0 ⫽ h 共 K p , K i , 0兲 , 1 ⫽ h ⬘ 共 K p , K i , 0兲 ⫽ 1 ⫽ h ⬘ 共 S p , S i , 0兲 ⫽ n ⫽ 0, 共 n ⬎ 1 兲, 0 ⫽ h 共 S p , S i , 0兲 , C ␣ ip i ␣i C ␣ ip i ␣i Ki , 共 n ⬎ 1 兲, while for Z satisfying 2h(S p , S i , Z) ⬎ h(K p , K i , Z), according to Eqs. (A9)–(A12) (see Appendix A), 0 ⫽ 关 2h 共 K p , K i , 0兲 h 共 S p , S i , 0兲兴 1/2, 0 ⫽ 2h 2 共 S p , S i , 0兲 / 0 , m! 共 n ⫺ m 兲 ! m⫽0 n⫺1 兺 ⫺ m⫽1 冋兺 n n ⫽ m n⫺m 2 0 , (33) 2h 共 m 兲 共 S p , S i , 0兲 h 共 n⫺m 兲 共 S p , S i , 0兲 m! 共 n ⫺ m 兲 ! m⫽0 n ⫺ 册冒 兺 m n⫺m m⫽1 册冒 0 , (34) h 共 x, y, 0兲 ⫽ h ⬘ 共 x, y, 0兲 ⫽ 1 ␣ ip p ␣p C ␣ ip i ␣i h 共 n 兲 共 x, y, 0兲 ⫽ 0, x⫹ C ␣ ip i ␣i y, y, 共 n ⭓ 2 兲. From Eqs. (33) and (34), coefficients n and n can be computed from the lower-order coefficients. Consequently, the sets of expansion coefficients 兵 a n 其 and 兵 b n 其 and then the reflectance and transmittance values can be computed by employing Eqs. (20) and (21) and Eqs. (24) and (25), respectively. C. Exponential Ink Penetration Apart from a linear distribution, one can imagine an exponential ink distribution as another typical example of inhomogeneous distribution. The driving force for this kind of ink distribution is a chemical distribution gradient. In the exponential case 共 Z 兲 ⫽ 1 exp关  共 z ⫺ D 兲兴 ⫽ 1 exp关 ␥ 共 Z ⫺ 1 兲兴 , Si , n ⫽ 0, h 共 m 兲 共 K p , K i , 0兲 h 共 n⫺m 兲 共 S p , S i , 0兲 where Z/ , h 共 x, y, Z兲 ⫽ n ⫽ (32) where Z is the rescaled coordinate variable 再 冋兺 n (31) Z⫽ (30) 0 ⭐ z ⭐ D, (35) where  is a quantity characterizing the ink penetration and D is an ‘‘effective’’ depth of ink penetration chosen such that ␥ ⫽  D Ⰷ 1 (say, D ⫽ 5/ ). Consequently exp(⫺␥) Ⰶ 1. Similar to the treatment for linear ink distribution, to cope with the situation when one must divide the layer of Yang et al. Vol. 21, No. 10 / October 2004 / J. Opt. Soc. Am. A 1949 ink penetration into two sublayers with the transition surface at Z ⫽ , the expression given in Eq. (35) is modified into 共 Z兲 ⫽ C exp关 ␦ 共 Z ⫺ 1 兲兴 , 0 ⭐ Z ⭐ 1, where C ⫽ 1 exp关␥ ( ⫺ 1)兴, ␦ ⫽ ␥ ; and C ⫽ 1 , ␦ ⫽ ␥ (1 ⫺ ) for the sublayers below and above the transition surface, respectively. The derivatives of h(x, y, Z) at Z ⫽ 0 are then h 共 x, y, 0兲 ⫽ 1 ␣ ip p ␣p x ⫹ exp共 ⫺␦ 兲 h 共 n 兲 共 x, y, 0兲 ⫽ exp共 ⫺␦ 兲 ␦ n C ␣ ip i ␣i C ␣ ip i ␣i y, y, (36) 共 n ⭓ 1 兲. (37) Therefore in the case 2h(S p , S i , Z) ⭐ h(K p , K i , Z), the Taylor expansion coefficients (expanded in the vicinity of Z ⫽ 0) become 0 ⫽ 0 ⫽ 1 ␣ ip up ␣p 1 ␣ ip up ␣p C ␣ ip K p ⫹ exp共 ⫺␦ 兲 S p ⫹ exp共 ⫺␦ 兲 n ⫽ exp共 ⫺␦ 兲 n ⫽ exp共 ⫺␦ 兲 ␦ n C ␣ ip n! u i ␣ i ␦ n C ␣ ip n! u i ␣ i ui ␣i C ␣ ip ui ␣i Ki , Si , Ki , Si . Conversely, for the region 2h(S p , S i , Z) ⬎ h(K p , K i , Z), the expansion coefficients in the vicinity of Z ⫽ 0, viz., 兵 n 其 and 兵 n 其 , can be computed by replacing h ( n ) (x, y, 0) in Eqs. (33) and (34) with Eqs. (36) and (37). 5. SIMULATIONS AND DISCUSSIONS The simulation presented here is aimed at demonstrating the methodology, flexibility, and applicability of the model rather than at direct comparison with experiments. To that end, two model systems of dyed sheets with homogeneous and linear ink distribution are studied. For ease of comparison between these ink distribution models, we assume that all of them have the same paper structure and contain the same amount of dye for each color. The K–M scattering and absorption powers of the paper S p z p , K p z p are shown in Fig. 9 of our previous work9 while those of inks S i z i , K i z i are taken from Fig. 5 of same. A. Homogeneous Media Distribution As shown in Section 4, spectral reflectance values of a homogeneous medium can be computed either analytically with Eq. (30) or numerically with the series solutions given by Eq. (24). Comparison of the two approaches with this example may allow us to test the convergence of the series solutions. Figure 4 shows the predictions of the spectral reflectance and transmittance values computed with different orders n of the series expansion. Corresponding values computed analytically with Eqs. Fig. 4. Convergence of the computed spectral reflectance values of primary inks with respect to different order of series expansion. The corresponding values computed analytically with Eqs. (30) and (31) are shown with dots (not visible under the n ⫽ 10 curve). (30) and (31) are denoted with dots in the figures. It is clear from the pictures that both the reflectance and transmittance values are effectively converged when n ⫽ 10. In other words, the series solution demonstrates fairly fast convergence. To study the effects of ink penetration, comparative computations with and without considering ink–paper mixing were carried out. When there is no ink–paper mixing, the ink forms a uniform ink layer on the paper surface. To avoid any possible complications due to surface reflections, only bulk reflectance is compared. In other words, quantities related to surface reflection (r 0 , r 1 , and r 2 ) in Eqs. (24) and (30) have been set at zero in the computations. Figure 5 demonstrates distinct peak and valley dependence on wavelength of illumination corresponding to transparent and absorption bands of inks, respectively. The effects of ink–paper mixing may be described as peak depression and valley raising compared with prints without ink–paper mixing. These effects occur because of the stronger scattering power of the ink– 1950 J. Opt. Soc. Am. A / Vol. 21, No. 10 / October 2004 paper mixture, resulting in a greater SIPV factor ( ip Ⰷ i ) in the transparent bands. In other words the minor absorption powers of the inks are significantly amplified by an increase in scattering 关 K ip ⬇ ( ip / i )K i 兴 . Also, because of the stronger scattering power, or the presence of paper material with strong scattering power, the ink–paper mixture becomes more reflective, which leads to the valley raising in the absorption bands. The combination of the depression and raising mechanisms drives the ink–paper mixture to significantly lower color saturation. This combination also has an effect on the hue of the colors because of the nonlinear response of human color vision to light stimulation. These trends explain the well-known phenomena of hue shift and saturation reduction observed experimentally. They also explain the observed reduction of color gamut on ink penetration.17 Yang et al. Fig. 7. Ink distribution with respect to depth of ink penetration z in cases of homogeneous and linear ink distribution. B. Linear Media Distribution The simulated spectral reflectance of an ink–paper mixture possessing a linear ink distribution (see Fig. 6) exhibits valley-raising features similar to those of the homogeneous ink distribution, even though peak depression plays a more dominant role. This can be well understood from the point of view of ink distribution. Since the ink concentration decreases linearly from the upper surface as shown in Fig. 7, the inks are concentrated mainly close to the top surface. Therefore the increasing scattering Fig. 8. Computed spectral reflectance of inked sheets with either homogeneous or linear ink distribution. The sheets have the same thickness and contain the same total amounts of inks. Fig. 5. Computed spectral reflectance of primary inks with and without considering ink–paper mixing in the case of homogeneous ink distribution. Fig. 6. Computed spectral reflectance of primary inks with and without considering ink–paper mixing in the case of linear ink distribution. power in the ink–paper mixture (compared to the ink layer) has a limited impact on the reflectance in the absorption bands. Nevertheless, it still plays a significant role in the transparent bands. It seems natural to make comparisons between the homogeneous and linear ink distributions. Since these two systems contain the same amount of ink as well as the same depth of ink penetration D, the differences exhibited are indications only of the different ink distributions. Figure 8 clearly shows the dependence of the computed spectral reflective properties on the forms of the two ink distributions. Generally speaking, the system with a homogeneous ink distribution exhibits larger reflectance and transmittance than does the system with a linear distribution. The explanation for the larger reflectance found with the homogeneous ink distribution is straightforward. Since both systems have the same amount of ink, there is a greater ink concentration close to the top surface in the case of a linear distribution (see Fig. 7) through which the light must pass (if not already absorbed) before it is reflected by the paper material. Consequently, the dyed sheet with the homogeneous ink distribution is less absorptive (more reflective) than that with the linear ink distribution. An important consequence of Fig. 8 is that it should be possible to distinguish Yang et al. homogeneous from inhomogeneous (e.g., linear) ink distribution by means of spectral reflectance measurements. Tests carried out on the convergence of the series expansions show that the computed spectral reflectance and transmittance values become essentially wholly converged at expansion order n ⫽ 10. Vol. 21, No. 10 / October 2004 / J. Opt. Soc. Am. A f 共 Z 兲 ⫽ K ip 共 Z 兲 ⫽ 关 2h 共 K p , K i , Z 兲 h 共 S p , S i , Z 兲兴 1/2, (A1) g 共 Z 兲 ⫽ S ip 共 Z 兲 ⫽ 2h 2 共 S p , S i , Z 兲 /f 共 Z 兲 , 1 ␣ ip h 共 x, y, Z 兲 ⫽ p ␣p 共 Z 兲 ␣ ip x⫹ i ␣i y. For ease of application, Eqs. (A1) and (A2) are written as f 2 共 Z 兲 ⫽ 2h 共 K p , K i , Z 兲 h 共 S p , S i , Z 兲 , f 共 Z 兲 g 共 Z 兲 ⫽ 2h 共 S p , S i , Z 兲 . 2 (A3) (A4) On the left-hand side of Eq. (A4) the nth order derivative of function f(Z)g(Z) equals n 关 f 共 Z 兲 g 共 Z 兲兴 共 n 兲 ⫽ 兺 m⫽0 n! m! 共 n ⫺ m 兲 ! f 共 m 兲 共 Z 兲 g 共 n⫺m 兲 共 Z 兲 n 兺 ⫽ f 共 Z 兲 g 共 n 兲共 Z 兲 ⫹ m⫽1 n! m! 共 n ⫺ m 兲 ! ⫻ 共 Z 兲 g 共 n⫺m 兲 共 Z 兲 . f 共m兲 (A5) On the right-hand side of Eq. (A4) there is 2 关 h 2 共 S p , S i , Z 兲兴 共 n 兲 n ⫽2 兺 m⫽0 n! m! 共 n ⫺ m 兲 ! h 共 m 兲 共 S p , S i , Z 兲 h 共 n⫺m 兲 共 S p , S i , Z 兲 . (A6) Therefore 冋兺 n g 共n兲 共Z兲 ⫽ m⫽0 2n! m! 共 n ⫺ m 兲 ! h 共 m 兲 共 S p , S i , Z 兲 h 共 n⫺m 兲 n ⫻ 共Sp , Si , Z兲 ⫺ 兺 m⫽1 ⫻ f 共 m 兲 共 Z 兲 g 共 n⫺m 兲 共 Z 兲 n! m! 共 n ⫺ m 兲 ! 册冒 f共 Z 兲. (A7) In an exactly analogous manner, one obtains 冋兺 n f 共 n 兲共 Z 兲 ⫽ m⫽0 n! m! 共 n ⫺ m 兲 ! ⫻ 共Sp , Si , Z兲 ⫺ h 共 m 兲 共 K p , K i , Z 兲 h 共 n⫺m 兲 1 n⫺1 兺 2 m⫽1 ⫻ f 共 m 兲 共 Z 兲 f 共 n⫺m 兲 共 Z 兲 册冒 n! m! 共 n ⫺ m 兲 ! f共 Z 兲. (A8) 0 ⫽ g共 Z 兲, (A9) Considering that 0 ⫽ f共 Z 兲, APPENDIX According to Eqs. (10) and (11) and (12) and (13) the K–M absorbing and scattering coefficients of the ink–paper mixture are expressed as (A2) where 6. SUMMARY Ink–paper interaction is a complex physical process depending on both the surface and bulk properties of paper and the rheological properties of inks. The irregularity and inhomogeneity of paper structure result in a variety of forms of ink penetration. Experimental as well as theoretical studies of ink penetration have proven to be very challenging because of the inherent complexity. Consequently, theoretical modeling becomes particularly important as it provides not only understanding and interpretation of measurements but also acts as a guide to experimental practices. In this paper we present a unified theoretical framework for studying light propagation in a layer of arbitrary ink distribution. The framework is an extension of the revised Kubelka–Munk theory taking into account major effects of scattering on the path of light propagation. The fluxes propagating downward and upward are represented by rapidly converging Taylor expansions. Existing formulas, the conventional and the matrix solutions of the Kubelka–Munk theory, have been shown to be special cases of the present framework. Applications to different forms of ink distribution—homogeneous, linear, and exponential—resulting from different mechanisms governing ink–paper interaction have been studied in detail. Simulations of spectral reflectance consisting of peak (reflective) and valley (absorption) bands exhibit similar features of ink penetration for both homogeneous and linear ink distributions. The effect of ink penetration is a combination of peak depressing and valley raising that results in significant hue shift, reduction of saturation, and, in turn, reduction in color gamut. An inhomogeneous ink distribution in printed paper has been suspected of causing visible artifacts. However, direct experimental characterization has proven to be very difficult with no reliable measuring method yet available to investigate the nature of the ink distribution. Microtome cuts and confocal microscopy are but two methods that have been applied. However, neither has given reliable results. As been pointed out by one of the reviewers, these ‘‘negative experiments’’ were never published. Considering the weaknesses of the original K–M theory, it is our hope that theoretical developments like the present study may be useful for experimental practices in the future. The present framework, still under development, is a continuing effort aimed at characterizing ink penetration and testing, and it is a joint project of research institutes and the paper-manufacturing industry. 1951 m ⫽ f 共m兲 m! 共 Z 兲, n ⫽ g共n兲 n! 共 Z 兲, (A10) one gets 1952 J. Opt. Soc. Am. A / Vol. 21, No. 10 / October 2004 冋兺 n n ⫽ m⫽0 1 m! 共 n ⫺ m 兲 ! n⫺1 1 兺 2 共 m 兲 共 n⫺m 兲 m⫽1 冋兺 册冒 0 , (A11) Corresponding author Li Yang’s e-mail address is [email protected]. REFERENCES 1. n m⫽0 by the Swedish Foundation for Strategic Research through the Surface Science and Printing Program (S2P2). h 共 m 兲 共 K p , K i , Z 兲 h 共 n⫺m 兲 ⫻ 共Sp , Si , Z兲 ⫺ n ⫽ Yang et al. 2 m! 共 n ⫺ m 兲 ! h 共m兲 共 Sp , Si , Z 兲h n ⫻ 共Sp , Si , Z兲 ⫺ 兺 共 m 兲 共 n⫺m 兲 m⫽1 共 n⫺m 兲 册冒 2. 3. 0 . 4. (A12) Therefore the nth order derivatives of functions f(Z) and g(Z) and f ( n ) (Z) and g ( n ) (Z) can be computed from their lower-order derivatives, as can those of h(x, y, Z). The derivative of function h(x, y, Z) depends on the form of ink penetration (Z). For linear ink penetration and the derivatives are h 共 1 兲 共 x, y, 0兲 ⫽ 6. 7. 共 Z 兲 ⫽ CZ ⫹ 0 h 共 x, y, 0兲 ⫽ 5. 8. 1 ␣ ip p ␣p C ␣ ip i ␣i h 共 n 兲 共 x, y, 0兲 ⫽ 0, x⫹ 0 ␣ ip i ␣i y, 9. 10. y, 11. 共 n ⭓ 2 兲. 12. For exponential ink distribution 共 Z 兲 ⫽ C exp关 ␦ 共 Z ⫺ 1 兲兴 , 共 0 ⭐ Z ⭐ 1 兲, 13. and the derivatives of h(x, y, Z) are then h 共 x, y, 0兲 ⫽ 1 ␣ ip p ␣p x ⫹ exp共 ⫺␦ 兲 h 共 n 兲 共 x, y, 0兲 ⫽ exp共 ⫺␦ 兲 ␦ n C ␣ ip i ␣i C ␣ ip i ␣i y, 14. 15. y, 共 n ⭓ 1 兲. ACKNOWLEDGMENTS The authors thank Patrick Emmel for valuable comments. Stimulating comments of the reviewers have been particularly helpful. This work has been supported 16. 17. P. Kubelka and F. Munk, ‘‘Ein Beitrag zur Optik der Farbanstriche,’’ Z. Tech. Phys. (Leipzig) 12, 593–601 (1931). P. Kubelka, ‘‘New contribution to the optics of intensely light-scattering materials. Part I,’’ J. Opt. Soc. Am. 38, 448–457 (1948). J. L. Saunderson, ‘‘Calculation of the color pigmented plastics,’’ J. Opt. Soc. Am. 32, 727–736 (1942). P. Kubelka, ‘‘New contribution to the optics of intensely light-scattering materials. Part II,’’ J. Opt. Soc. Am. 44, 330–335 (1954). A. Mandelis and J. P. 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Wyszecki, ‘‘Physics and psychophysics of colorant layers,’’ in Color in Business, Science and Industry, 3rd ed. (Wiley, New York, 1975). P. Emmel, ‘‘Modèles de prédiction couleur appliqués á l’impression jet d’encre,’’ Thèse No. 1857 (École Polytechnique Fédérale de Lausanne, Lausanne, Switzerland, 1998). P. Emmel and R. D. Hersch, ‘‘Towards a color prediction model for printed patches,’’ IEEE Comput. Graphics Appl. 19, 54–60 (1999). P. Emmel and R. D. Hersch, ‘‘A unified model for color prediction of halftoned prints,’’ J. Imaging Sci. Technol. 44, 351–359 (2000). L. Yang, ‘‘Ink–paper interaction: a study in ink-jet color reproduction,’’ Ph.D thesis, dissertation No. 806 (Linköping University, Linköping, Sweden, 2003). O. Norberg and M. Andersson, ‘‘Focusing on paper properties in color characterization of printing situations,’’ in IS&T’s NIP18: International Conference on Digital Printing Technologies (Society for Imaging Science and Technology, Springfield, Va., 2002), pp. 774–776.
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