Water Resources Research Supporting Information for Gas Pressure Gradients in Unsaturated Porous Media and the Assumption of Infinite Gas Mobility Lili Hou1, Brent E. Sleep2, and Tohren C. G. Kibbey1 1University of Oklahoma of Toronto 2University Contents of this file: Text S1. Calibration Details For Figures 3 and 4………………………………… p. 2 Text S2. Versions of Fig. 3 and 4 showing corresponding VG-based simulations…………………………………………………………………. p. 3 Text S3. Simulation Details for Figures 7 and 8 – Stauffer [1978] Data…….… p. 5 Text S4. Simulation Details for Figure 9 – Illustration of Eq. 3…………………. p. 5 Text S5. Derivation of Eq. 3.………………………………………………………….. p. 5 Text S6. Replicate experiments…………………………………………………….. p. 7 Text S7. Outflow comparisons….………………………………………………….. p. 8 1 Text S1. Calibration Details For Figures 3 and 4: Table S1 below shows the parameters used in the BC and VG simulations of the data in Figures 3 and 4 of the paper: Table S1. Simulation parameters used for the data in Figs 3, 4 (BC) and S3, S4 (VG). BC k (m2) L (m)* 0.001 Inlet 0.1524 Sand 0.001 System 0.001 VG k (m2) No added resistance Added inlet resistance Added outlet resistance No added resistance Added inlet resistance Added outlet resistance (Fig 3) (Fig. 4A) (Fig. 4B) (Fig. S3) (Fig. S4A) (Fig. S4B) n/a 1.1010 -11 9.0610 -16 1.1010 -11 n/a 1.1010 9.0610 -16 n/a 7.8110 -12 7.8110-12 1.5010-13 n/a 6.0410-14 n/a 1.5010-13 n/a -11 7.8110 -12 6.0410-14 n/a 1.5010-13 Outlet 1.5010-13 n/a Pd (m) 0.70 0.66 0.66 α (m-1) 1.31 1.40 1.40 8.5 8.5 8.5 n 16 16 16 2.5010-14 2.5010-14 * L values correspond to length in the model. Notes on Table S1: 1. All boundary permeabilities (inlet, system, outlet) correspond to the specific length of the boundary region in the model. (Because all experience single-phase flow, lengths are arbitrary.) 2. Pc-S scaling parameters (Pd, ) were observed to vary slightly with packings, and from run-to-run in re-saturated columns, likely due to changes to the packing density caused by backflushing during re-saturation. Note that no systematic relationship between Pc-S parameters and flow rate was observed across all experiments conducted. 3. The experiment with added inlet resistance was the third run of a re-saturated column (the first was the system with no added resistance in Fig. 3, the second was a run with lower inlet resistance, shown in Fig. S6 below). As such, the slightly lower system permeability needed in the calibration of the experiment with added inlet resistance is consistent with the reduction in membrane permeability typically observed over multiple runs. 4. Comparison with measured permeabilities: As mentioned in the text, the sand permeability was measured at 7.8110-12 m2 in falling head measurements conducted for this work. While it is likely that the true k varied from packing to packing, that measured value was used in all VG simulations. Regardless of boundary properties, BC simulations were found to drain more slowly for a given k, so a higher k was used in BC simulations to duplicate the outflow behavior of the VG runs. Note that subsequent falling head measurements of equivalent k for the tubing used in the experiments found: koutlet_permeability = 2.4810-14 m2 ** kinlet_permeability= 1.3210-15 m2 ** **NOTE: both values are equivalent permeabilities based on L=0.001 m (Table S1) 2 The measured outlet value is very close to the value determined by calibration in Table S1. The measured inlet value is approximately 50% greater than the calibrated value. Note, however, that the measured value was determined with water at a much slower rate than the air flow during column drainage; it is probable that minor losses (particularly gas expansion from the small tubing to the larger nylon tubing) are significant in the inlet during actual experiments, so the measurement is consistent with the calibrated value. Text S2. Versions of Fig. 3 and 4 showing corresponding van Genuchten-based simulations: Note that BC simulations capture average saturation behavior slightly more accurately than VG simulations, but pressure drop magnitudes are quantitatively similar in both. VG simulations are shown below. 1.0 250 0.9 200 0.8 150 0.7 Pg applied Pg obs. Pw obs. Pg sim. Pw sim. Savg sim. 100 50 0.6 Water saturation, S Pressure, cm water 30 cm 0.5 Smid sim. 0.4 0 -10 0 10 20 30 40 50 Time, s Figure S3. Measured (symbols) and simulated (green lines) pressures during drainage in a system with no added inlet or outlet flow resistance. Average and local saturations from simulations (red lines) are shown for reference. VG simulations shown. 3 1.0 250 0.8 150 0.7 Pg applied Pg obs. Pw obs. Pg sim. Pw sim. Savg sim. 100 50 Smid 0.6 A. Inlet resistance added sim. Water saturation, S Pressure, cm water 0.9 100 cm 200 0.5 0.4 0 50 Pressure, cm water 250 100 150 Time, s 1.0 10 cm 0.9 200 0.8 150 0.7 Pg applied Pg obs. Pw obs. Pg sim. Pw sim. Savg sim. 100 50 Smid sim. 0.6 B. Outlet resistance added Water saturation, S 0 0.5 0.4 0 0 50 100 150 Time, s Figure S4. Measured (symbols) and simulated (green lines) pressures during drainage in systems with A. added inlet resistance, and B. added outlet resistance. Average and local saturations from simulations (red lines) are shown for reference. VG simulations shown. 4 Text S3. Simulation Details for Figures 7 and 8 – Stauffer [1978] Data: The simulation of the data from Stauffer [1978] was based on BC parameters and other soil parameters reported by Stauffer. Note that although Stauffer reported soil parameters for several levels within his column, all were extremely similar; for this reason the simulation was conducted assuming a homogeneous column. Because the measurements of interest were conducted at the top of the column, reported soil parameters from the top portion were used throughout the simulated column. Parameters used were: Ksat = 2.1710-4 m/s; n=0.332; Swr=0.12; =5.7; Pd=31.8 cm water. The saturated outlet portion of the column (including tubing) had a reported equivalent Ksat=6.410-4 m/s. The column had a reported height of 63.8 cm, while the outlet portion had a reported height of 37.7 cm. In the simulation, a block height of 0.1 cm was used, so 638 grid blocks represented the column portion, and 37.8 blocks represented the outlet portion. A sufficiently high air entry pressure was used for the outlet portion for it to serve as a capillary barrier. (The actual value was not specified by Stauffer, but is not critical, as the front does not reach the outlet portion until later times than those shown in Fig. 7.) It is interesting to note that the Ksat values reported by Stauffer were determined from his unsaturated data using a method based on the Brooks-Corey-Burdine relative permeability relationship. That is the likely reason that BC simulations using those Ksat values agreed so well with observed outflow behavior, while the permeability values determined from falling head measurements in this work underestimated flow in BC simulations (but not VG simulations). Text S4. Simulation Details for Figure 9 – Illustration of Eq. 3: The simulation in Figure 9 used to illustrate Eq. 3 was based on a hypothetical medium sand, slightly finer than the sand used by Stauffer, but coarser than the fine sand used in experiments for this work. Parameters used were: =6.0; Pd=40.0 cm water, k=1.010-11 m2, n=0.37, Swr=0.1). The simulated vertical column had 100 0.5 cm grid blocks, for a total height of 50 cm. Two high-conductivity, low-air-entry grid blocks located below z=0 simulated a high permeability bottom membrane. The simulation involved a 200 cm water gas pressure input. Text S5. Derivation of Eq. 3: Equation 3 provides an estimate of the rate at which gas pressure varies in space away from the moving front. The derivation of the equation is based on two main assumptions: 1. the assumption that the water pressure head gradient remains approximately constant across the front, and 2. the assumption that the spatial variation in Pc right at the front will be equal to- or greater than the variation that would be observed in a static Pc-S relationship in a vertical column. Both assumptions were found to be consistent with BC simulations in both vertical and horizontal columns. From Darcy’s Law: 𝜕ℎ 𝑞𝑜𝑢𝑡 = +𝐾𝑠𝑎𝑡 𝜕𝑠 (S1) where h is piezometric head, qout is Darcy velocity of water leaving the column in the direction of the movement of the front, and s is a spatial axis the direction toward the inlet of the column. (The positive sign comes from the opposite conventions for qout and s.) In terms of pressure head, Eq. S1 becomes: 5 𝑞𝑜𝑢𝑡 = 𝐾𝑠𝑎𝑡 𝜕 (𝑧 + 𝑃𝑤 ) 𝜕𝑠 (S2) where Pw is pressure (in head units), and z is elevation. Recognizing that 𝜕𝑧⁄𝜕𝑠 =sin , where is the angle of the column from horizontal: 𝑞𝑜𝑢𝑡 𝜕𝑃𝑤 (S3) = 𝑠𝑖𝑛𝜃 + 𝐾𝑠𝑎𝑡 𝜕𝑠 In equation form, Assumption 2 is equivalent to: 𝜕𝑃𝑐 = 1.0 𝜕𝑠 (S4) In a vertical column if no drainage is occurring, Eq. S4 would hold exactly. Simulations suggest that it is reasonably close right at the front even for moderately rapid drainage, with the 1.0 value forming a minimum value. Simulations also suggest that Eq. S4 is equally valid in horizontal drainage. Substituting the definition of Pc gives: 𝜕𝑃𝑐 𝜕𝑃𝑔 𝜕𝑃𝑤 (S5) = − = 1.0 𝜕𝑠 𝜕𝑠 𝜕𝑠 Finally, substituting S3 into S5 and rearranging gives: 𝑑𝑃𝑔 𝑞𝑜𝑢𝑡 = + 1.0 − 𝑠𝑖𝑛𝜃 𝑑𝑠 𝐾𝑠𝑎𝑡 (S6) Or, recognizing that the 1.0 is a minimum value: 𝑑𝑃𝑔 𝑞𝑜𝑢𝑡 ≳ + 1.0 − 𝑠𝑖𝑛𝜃 𝑑𝑠 𝐾𝑠𝑎𝑡 (3) 6 Text S6. Replicate experiments Experiments a and b shown below correspond to replicates of the experiment shown in Figure 3 (c is the data from Fig. 3). Experiment d corresponds to an experiment conducted with low added inlet resistance (low enough that it is essentially a replicate of the system without added resistance). 300 Applied 250 Pressure (cm water) Gas 200 Water 150 100 a b c d 50 0 -10 0 10 20 30 40 50 time (s) Figure S6. Experimental data for three systems with no added inlet or outlet resistance (a, b, c) and one with very low inlet resistance (d). Note that although the timing differs slightly in the four experiments, the magnitudes of the gas pressure drops are quantitatively similar for all four. It should be noted that experiments a and b were recorded at longer, 3 sec. intervals, causing the curves to have an angular appearance where straight lines connect the more widely-spaced data points. Note also that none of the water pressure sensor data above are corrected for response rate. Experiments a and b were conducted in the same packing (re-saturated for expt. b). Experiments c and d were conducted in another packing (re-saturated for expt. d). The packing used for expt. d was also subsequently resaturated for the experiment with added inlet resistance (Fig. 4A). 7 Text S7. Comparison between measured and simulated outflow Figure S7 shows a comparison between the measured and simulated outflow for the BC simulations shown in Figures 3 and 4. 25 No added resistance Simulation (BC) Outflow (g) 20 14 12 10 15 Outflow (g) 8 6 10 4 2 t (sec) 0 5 0 50 100 150 200 250 0 0 2000 4000 6000 8000 10000 t (sec) 25 Inlet resistance Simulation (BC) Outflow (g) 20 14 12 10 15 Outflow (g) 8 6 10 4 2 t (sec) 0 5 0 50 100 150 200 250 0 0 2000 4000 6000 8000 10000 t (sec) 25 Outlet resistance Simulation (BC) Outflow (g) 20 14 12 10 15 Outflow (g) 8 6 10 4 2 t (sec) 0 5 0 50 100 150 200 250 0 0 2000 4000 6000 8000 10000 t (sec) Figure S7. Comparison between experimental and simulated outflow data for the experiments in Figure 3 and 4. 8