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NASA NTRS2013

Relationships between the Raindrop Size Distribution and Properties of the Environment and Clouds Inferred from TRMM

Variability in the raindrop sized distribution (DSD) has long been recognized as a source of uncertainty in relationships between radar reflectivity Z and rain rate R. In this study, we analyze DSD retrievals from two years of data gathered by the Tropical Rainfall Measuring Mission (TRMM) satellite and processed with a combined radar-radiometer retrieval algorithm over the global oceans equatorward of 35◦. Numerous variables describing properties of each reflectivity profile, large-scale organization, and the background environment are examined for relationships to the reflectivity-normalized median drop diameter, epsilonDSD. In general, we find that higher freezing levels and relative humidities are associated with smaller epsilonDSD. Within a given environment, the mesoscale organization of precipitation and the vertical profile of reflectivity are associated with DSD characteristics. In the tropics, the smallest epsilonDSD values are found in large but shallow convective systems, where warm rain formation processes are thought to be predominant, whereas larger sizes are found in the stratiform regions of organized deep convection. In the extratropics, the largest epsilonDSD values are found in the scattered convection that occurs when cold, dry continental air moves over the much warmer ocean after the passage of a cold front. The geographical distribution of the retrieved DSDs is consistent with many of the observed regional Z−R relationships found in the literature as well as discrepancies between the TRMM radar-only and radiometer-only precipitation products. In particular, mid-latitude and tropical regions near land tend to have larger drops for a given reflectivity, whereas the smallest drops are found in the eastern Pacific Intertropical Convergence Zone.

raindrop size distribution↗

NASA NTRS2018

A Modified Dual-Wavelength Technique for Ku- and Ka-Band Radar Rain Retrieval

A modified dual-wavelength radar technique is described in an attempt to eliminate double solutions of DSD that the standard dual-wavelength technique faces for small-to moderate rain rates. Assessment of the methods is made from the simulated hydrometeor profiles comprised of measured DSD. Preliminary results reveal that the modified radar technique has potential to improve accuracy of DSD and rain retrieval over the standard dual-wavelength radar technique.

Liao, Liang↗

NASA NTRS2019

Physical Evaluation of GPM DPR Single- and Dual-Wavelength Algorithms

A physical evaluation of the rain profiling retrieval algorithms for the Dual-frequency Precipitation Radar (DPR) aboard the Global Precipitation Measurement (GPM) core satellite is carried out by applying them to the hydrometeor profiles generated from measured raindrop size distributions (DSD). The DSD-simulated radar profiles are used as input to the algorithms, and their estimates of hydrometeors' parameters are compared with the same quantities derived directly from the DSD data (or truth). The retrieval accuracy is assessed by the degree to which the estimates agree with the truth. To check the validity and robustness of the retrievals, the profiles are constructed for cases ranging from fully correlated (or uniform) to totally uncorrelated DSDs along the columns. Investigation into the sensitivity of the retrieval results to the model assumptions is made to characterize retrieval uncertainties and identify error sources. Comparisons between the single- and dual-wavelength algorithm performance are carried out with either a single- or dual-wavelength constraint of the path integral or differential path integral attenuation. The results suggest that the DPR dual-wavelength algorithm generally provides accurate range-profiled estimates of rainfall rate and mass-weighted diameter with the dual-wavelength estimates superior in accuracy to those from the single-wavelength retrievals.

Liang Liao↗

NASA NTRS2021

Inference of Precipitation in Warm Stratiform Clouds using Remotely Sensed Observations of the Cloud Top Droplet Size Distribution

Drizzle is a common feature of warm stratiform clouds and it influences their radiative effects by modulating their physical properties and lifecycle. An important component of drizzle formation are processes that lead to a broadening of the droplet size distribution (DSD). Here, we examine observations of cloud and drizzle properties retrieved using colocated airborne measurements from the Research Scanning Polarimeter and the Third Generation Airborne Precipitation Radar. We observe a bimodal DSD as the aircraft transects drizzling open-cells whereby the larger mode reaches a maximum size near cloud center and the smaller mode remains relatively constant in size. We review similarities between our observations with droplet growth processes and their connections with precipitation onset. We estimate droplet sedimentation using the cloud top DSD and find a correlation with rain water path of 0.82. We also examine how changes in liquid water paths and droplet concentrations may act to enhance or suppress precipitation.

Droplet size distribution↗

NASA NTRSDate not supplied

Evolution of Drop Size Distributions during Hurricane Harvey and Their Effects on Rain Intensity

Hurricane Harvey hit the Texas Gulf Coast as a major hurricane on August 25, 2017, before exiting the state as a tropical storm on August 29, 2017. Left in its wake was historic flooding over southeast Texas with some locations measuring more than 60 inches of rain. The Houston NEXRAD radar (KHGX) maintained operations for the entirety of the event and is utilized in this study to better understand the evolution of the drop size distribution (DSD) in the lower (liquid) portions of the storm and how changes in the DSD were tied to observed and measured changes in rain intensities. From the KHGX dual-polarimetric radar data several DSD parameters were retrieved, including three different rain rate retrievals, as well as the mass-weighted mean-drop diameter Dm, and the normalized intercept parameter NW of the gamma distribution. Two of the rain retrievals are popular hybrid approaches, where reflectivity, differential and specific differential phase are used. The other is an attenuation-based retrieval. In a previous study, it was found that both hybrid retrievals significantly underestimated the rainfall during the heaviest rain periods, while the attenuation-based retrieval, with proper adjustment, agreed quite well with a large network of gauges from the Harris County Flood Warning System. Using Dm and NW as proxies for drop size and concentration, respectively, we will show that the heaviest rain intensities were associated in areas of the storm where there was a large concentration of large drops present. It is envisaged that results of this study can be used to develop a near-real-time tuning of the attenuation-based retrieval, thus providing timely, and possibly life-saving warnings during inundating rainfall.

David B. Wolff↗

NASA NTRS2021

Retrieving Rain Drop Size Distribution Moments from GPM Dual-Frequency Precipitation Radar

A novel method for retrieving the moments of rain drop size distribution (DSD) from the dual-frequency precipitation radar (DPR) onboard the global precipitation mission satellite (GPM)is presented. The method involves the estimation of two chosen reference moments from two specific DPR products, namely the attenuation-corrected Ku-band radar reflectivity and (if made available) the specific attenuation at Ka-band. The reference moments are then combined with a function representing the underlying shape of the DSD based on the generalized gamma model. Simulations are performed to quantify the algorithm errors. The performance of methodology is assessed with two GPM-DPR overpass cases over disdrometer sites, one in Huntsville, Alabama and one in Delmarva peninsula, Virginia, both in the US. Results are promising and indicate that it is feasible to estimate DSD moments directly from DPR-based quantities.

Merhala Thurai↗

DOE OSTI2017

Level set methods for detonation shock dynamics using high-order finite elements

Level set methods are a popular approach to modeling evolving interfaces. We present a level set ad- vection solver in two and three dimensions using the discontinuous Galerkin method with high-order nite elements. During evolution, the level set function is reinitialized to a signed distance function to maintain ac- curacy. Our approach leads to stable front propagation and convergence on high-order, curved, unstructured meshes. The ability of the solver to implicitly track moving fronts lends itself to a number of applications; in particular, we highlight applications to high-explosive (HE) burn and detonation shock dynamics (DSD). We provide results for two- and three-dimensional benchmark problems as well as applications to DSD.

finite element methods↗

DOE OSTI2016

Steady detonation propagation in a circular arc: a Detonation Shock Dynamics model

We study the physics of steady detonation wave propagation in a two-dimensional circular arc via a Detonation Shock Dynamics (DSD) surface evolution model. The dependence of the surface angular speed and surface spatial structure on the inner arc radius ( $R_{i}$ ), the arc thickness ( $R_{e}-R_{i}$ , where $R_{e}$ is the outer arc radius) and the degree of confinement on the inner and outer arc is examined. We first analyse the results for a linear $D_{n}$ – $\unicode[STIX]{x1D705}$ model, in which the normal surface velocity $D_{n}=D_{CJ}(1-B\unicode[STIX]{x1D705})$ , where $D_{CJ}$ is the planar Chapman–Jouguet velocity, $\unicode[STIX]{x1D705}$ is the total surface curvature and $B$ is a length scale representative of a reaction zone thickness. An asymptotic analysis assuming the ratio $B/R_{i}\ll 1$ is conducted for this model and reveals a complex surface structure as a function of the radial variation from the inner to the outer arc. For sufficiently thin arcs, where $(R_{e}-R_{i})/R_{i}=O(B/R_{i})$ , the angular speed of the surface depends on the inner arc radius, the arc thickness and the inner and outer arc confinement. For thicker arcs, where $(R_{e}-R_{i})/R_{i}=O(1)$ , the angular speed does not depend on the outer arc radius or the outer arc confinement to the order calculated. It is found that the leading-order angular speed depends only on $D_{CJ}$ and $R_{i}$ , and corresponds to a Huygens limit (zero curvature) propagation model where $D_{n}=D_{CJ}$ , assuming a constant angular speed and perfect confinement on the inner arc surface. Having the normal surface speed depend on curvature requires the insertion of a boundary layer structure near the inner arc surface. This is driven by an increase in the magnitude of the surface wave curvature as the inner arc surface is approached that is needed to meet the confinement condition on the inner arc surface. For weak inner arc confinement, the surface wave spatial variation with the radial coordinate is described by a triple-deck structure. The first-order correction to the angular speed brings in a dependence on the surface curvature through the parameter $B$ , while the influence of the inner arc confinement on the angular velocity only appears in the second-order correction. For stronger inner arc confinement, the surface wave structure is described by a two-layer solution, where the effect of the confinement on the angular speed is promoted to the first-order correction. We also compare the steady-state arc solution for a PBX 9502 DSD model to an experimental two-dimensional arc geometry validation test.

Short, Mark↗

DOE OSTI2019

Accurate Binding Energies for Lithium Polysulfides and Assessment of Density Functionals for Lithium–Sulfur Battery Research

Lithium–sulfur batteries have high theoretical energy density, but a better knowledge of their intimate structural details will be helpful in improving their conductivity and long-term cycling behavior. In order to identify the stationary configurations of lithium polysulfides (Li 2 S n , 2 ≤ n ≤ 8) formed in the charging and discharging processes of the lithium–sulfur batteries, ab initio molecular dynamics was employed to sample the configuration space of Li 2 S n , followed by optimization of structures by CCSD(T)-F12b/aug-cc-pVDZ. Here, using the optimized stationary points, we have created the LiSAE38 benchmark database of atomization energies (AEs) of 38 lithium polysulfide isomers by using the higher-level WMS and W3X-L methods. In addition, the performances of 39 density functionals have been assessed against the benchmark AEs and the relative stabilities of Li 2 S n isomers. On the basis of the assessments with the def2-QZVP basis set, the PW6B95, B97-1, B3LYP-D3, TPSS, and DSD-PBEP86 density functionals are the most accurate for the AEs, whereas the mPW2-PLYP-D, DSD-PBEP86, PW6B95, HSE06, and PBEQIDH functionals are most accurate for the relative energies. Local functionals are of special interest because of their lower cost (faster timings in terms of computer resources) for large systems; among the tested local functionals, MN15-L and revM06-L are the most accurate for the calculations of relative stabilities.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗

DOE OSTI2017

Anomalous Structural Disorder in Supported Pt Nanoparticles

Supported Pt nanocatalysts generally exhibit anomalous behavior, including negative thermal expansion and large structural disorder. Finite temperature DFT/MD simulations reproduce these properties, showing that they are largely explained by a combination of thermal vibrations and low-frequency disorder. We show in this paper that a full interpretation is more complex and that the DFT/MD mean-square relative displacements (MSRD) can be further separated into vibrational disorder, “dynamic structural disorder” (DSD), and long-time equilibrium fluctuations of the structure dubbed “anomalous structural disorder” (ASD). We find that the vibrational and DSD components behave normally, increasing linearly with temperature while the ASD decreases, reflecting the evolution of mean nanoparticle geometry. Finally, as a consequence the usual procedure of fitting the MSRD to normal vibrations plus temperature-independent static disorder results in unphysical bond strengths and Grüneisen parameters.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗

DOE OSTI2019

Three‐Moment Representation of Rain in a Bulk Microphysics Model

Abstract A bulk three‐moment representation for rain microphysics is developed and implemented in the Predicted Particle Properties (P3) microphysics scheme. In addition, a new parameterization for rain self‐collection and collisional breakup (RSCB) is presented using a lookup table approach, based on the Spectral‐Bin Model (SBM). To quantify the impacts of sedimentation, evaporation, and RSCB on drop size distributions (DSDs), a rain shaft model is applied to a wide range of atmospheric scenarios (i.e., initial conditions and regimes) and compared against results from the SBM. DSD shapes are mainly determined by both sedimentation and evaporation, except in heavy rain where the impact of RSCB on DSD shape becomes more important than evaporation. The new parameterization for RSCB has a considerable impact on the mean drop size, improving the agreement between P3 and SBM. Only 4% of the original two‐moment rainshaft simulations have mean drop sizes and rain rates within ±20% of the SBM results, but this increases to more than 95% agreement when the three‐moment rain representation is used together with the new parameterization for RSCB. Generally, the improvement is more significant for heavy rain than for light drizzle. Remaining differences between bin and bulk model are attributable to treatments of evaporation, and the restriction to gamma DSDs in P3.

precipitation↗

DOE OSTI2022

Observed and Bin Model Simulated Evolution of Drop Size Distributions in High-Based Cumulus Congestus Over the United Arab Emirates

This study examines microphysical processes in developing high-based cumulus congestus over the United Arab Emirates using aircraft observations and a large-eddy-simulation model with bin microphysics. A notable feature of this case is the lack of mm-sized drops despite having a liquid cloud layer >3.5 km deep, contrasting with copious large drops observed in maritime tropical cumulus congestus having a similar vertical extent. Modeled drop size distributions are similar to observations at various temperatures between 9.5 and –12°C, including the lack of mm-sized drops. Cloud dilution leads to low-to-moderate liquid water contents (~0.5–1.5 g m –3 ) in most of the cloud core, several times smaller than adiabatic values. Dilution is enhanced in the inflowing branch of the toroidal circulations associated with individual cloud thermals, which are favored regions for secondary droplet activation (activation above cloud base). Secondary activation in general contributes substantially to the droplet population. Turning it off leads to a sharp decrease in droplet concentration and increase in mean size aloft, but does little to increase rain drop production. Warm rain generation (or lack thereof) in this case is therefore determined more by the sub-cloud aerosol and the cloud base droplet size distribution (DSD) than DSD evolution aloft from secondary droplet activation. Decreasing the aerosol concentration by a factor of 10 greatly increases production of large drops via collision-coalescence. Thus, despite its high base (low temperatures) and substantial dilution, the simulated cloud is thermodynamically and dynamically capable of rapidly producing copious mm-sized drops from collision-coalescence under pristine aerosol conditions.

54 ENVIRONMENTAL SCIENCES↗

DOE OSTI2023

Observational Investigation of the Effect of Turbulence on Microphysics and Precipitation in Warm Marine Boundary Layer Clouds

Abstract Turbulence is omnipresent in the marine boundary layer (MBL) and several mechanisms have been proposed regarding its role on MBL cloud microphysics. In particular, past modeling studies suggested that increasing turbulence broaden the droplet size distribution (DSD) and leads to precipitation initiation, this suggested relationship has not been evaluated yet using long‐term observations. Here, comprehensive retrievals from long‐term ground‐based observations are used to explore the impact of turbulence on microphysics and precipitation in drizzling MBL clouds. Our analysis supports that broader DSD and larger droplets are observed with strong turbulence, but interestingly, the precipitation is reduced instead of being enhanced. This suppression mechanism is mainly due to the entrainment and mixing process in which the entrained dry air evaporates cloud water. This study provides observational evidence to show the complex effect of turbulence on MBL cloud properties and implies the potential influence of turbulence on the clouds lifetime.

54 ENVIRONMENTAL SCIENCES↗

DOE OSTI2024

Evaluation of Autoconversion Representation in E3SMv2 Using an Ensemble of Large-Eddy Simulations of Low-Level Warm Clouds

In numerical atmospheric models that treat cloud and rain droplet populations as separate condensate categories, precipitation initiation in warm clouds is often represented by an autoconversion rate (Au), which is the rate of formation of new rain droplets through the collisions of cloud droplets. Being a function of the cloud droplet size distribution (DSD), the local Au is commonly parameterized as a function of DSD moments: cloud droplet number (n c ) and mass (q c ) concentrations. When applied in a large-scale model, the grid-mean Au must also include a correction, or enhancement factor, to account for the horizontal variability of the cloud properties across the model grid. In this study, we evaluate the Au representation in the Energy Exascale Earth System Model version 2 (E3SMv2) climate model using large-eddy simulations (LES), which explicitly resolve cloud droplet spectra, and therefore the local Au, as well as its spatial variability. The analysis of an ensemble of warm low-level cloud cases shows that the E3SMv2 formulation represents the Au reasonably well compared to the horizontally averaged explicitly computed rate from LES. The agreement, however, comes from a combination of an underestimated E3SM-tuned local Au rate and an overestimated subgrid cloud variability enhancement factor. The latter bias is traced to neglecting the horizontal variability of n c and its co-variability with q c in parameterizing the grid-mean Au.

54 ENVIRONMENTAL SCIENCES↗

DOE OSTI2025

Giant Cloud Condensation Nuclei Facilitate Drizzle Formation in Stratocumulus—Insights From a Combined Observation‐Modeling Framework

The mechanism for initiating drizzle drop remains a gap in the current understanding of warm rain formation. One prevalent hypothesis suggests that the presence of Giant Cloud Condensation Nuclei (GCCN) generates drizzle‐sized drops necessary to trigger the Collision‐Coalescence (C‐C) process. Here, in this study, this hypothesis is investigated using a novel framework that integrates in situ observations, remote sensing measurements, and idealized models. Results show that GCCN can efficiently generate drizzle drops through condensation, producing a broad Droplet Size Distribution (DSD) comparable to in situ observations. The large drizzle drop and broad DSD strongly facilitate C‐C, further accelerating drizzle initiation. To compare with observation, the model‐generated DSDs are used to generate radar Doppler spectra where radar reflectivity and Doppler skewness is estimated. The simulated radar quantities correspond well with radar observations, providing critical evidence for the GCCN‐induced drizzle initiation mechanism.

54 ENVIRONMENTAL SCIENCES↗

DOE OSTI2018

Survival of the most transferable at the top of Jacob’s ladder: Defining and testing the ω B97M(2) double hybrid density functional

A meta-generalized gradient approximation, range-separated double hybrid (DH) density functional with VV10 non-local correlation is presented. The final 14-parameter functional form is determined by screening trillions of candidate fits through a combination of best subset selection, forward stepwise selection, and random sample consensus (RANSAC) outlier detection. The MGCDB84 database of 4986 data points is employed in this work, containing a training set of 870 data points, a validation set of 2964 data points, and a test set of 1152 data points. Following an xDH approach, orbitals from the ωB97M-V density functional are used to compute the second-order perturbation theory correction. The resu|ting functional, ωB97M(2) is benchmarked against a variety of leading double hybrid density functionals, including B2PLYP-D3(BJ), B2GPPLYP-D3(BJ), ωB97X-2(TQZ), XYG3, PTPSS-D3(0), XYGJ-OS, DSD-PBEP86-D3(BJ), and DSD-PBEPBE-D3(BJ). Encouragingly, the overall performance of ωB97M(2) on nearly 5000 datq points clearly surpasses that of all of the tested density funstionals. As a Rung 5 density functional, ωB97M(2) completes our family of combinatorially optimized functionals, complementing B97M-V on Rung 3, and ωB97X-V and ωB97M-V on Rung 4. The results suggest that ωB97M(2) has the potential to serve as a powerful predictive tool for accurate and efficient electronic structure calculations of main-group chemistry.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗

DOE OSTI2017

Impacts of Instrument Limitations on Estimated Raindrop Size Distribution, Radar Parameters, and Model Microphysics during Mei-Yu Season in East China

Instrumentation limitations on measured raindrop size distributions (DSDs) and their derived relations and physical parameters are studied through a comparison of the DSD measurements during mei-yu season in east China by four collocated instruments, that is, a two-dimensional video disdrometer (2DVD), a vertically pointing Micro Rain Radar (MRR), and two laser-optical OTT Particle Size Velocity (PARSIVEL) disdrometers (first generation: OTT-1; second generation: OTT-2). Among the four instruments, the 2DVD provides the most accurate DSD and drop velocity measurements, so its measured rainfall amount has the best agreement with the reference rain gauge. Other instruments tend to miss more small drops ( D < 1 mm), leading to inaccurate DSDs and a lower rainfall amount. The low rainfall estimation becomes significant during heavy rainfall. The impacts of instrument limitations on the microphysical processes (e.g., evaporation and accretion rates) and convective storm morphology are evaluated. This is important especially for mei-yu precipitation, which is dominated by a high concentration of small drops. Furthermore, the instrument limitations need to be taken into account in both QPE and microphysics parameterization.

47 OTHER INSTRUMENTATION↗

DOE OSTI2019

On the Realism of the Rain Microphysics Representation of a Squall Line in the WRF Model. Part I: Evaluation with Multifrequency Cloud Radar Doppler Spectra Observations

This study investigates how multifrequency cloud radar observations can be used to evaluate the representation of rain microphysics in the WRF Model using two bulk microphysics schemes. A squall line observed over Oklahoma on 12 June 2011 is used as a case study. A recently developed retrieval technique combining observations of two vertically pointing cloud radars provides quantitative description of the drop size distribution (DSD) properties of the transition and stratiform regions of the squall-line system. For the first time, the results of this multifrequency cloud radar retrieval are compared to more conventional retrievals from a nearby polarimetric radar, and a supplementary result of this work is that this new methodology provides a much more detailed description of the DSD vertical and temporal variations. While the extent and evolution of the squall line is well reproduced by the model, the 1-h low-reflectivity transition region is not. In the stratiform region, simulations with both schemes are able to reproduce the observed downdraft and the associated significative subsaturation below the melting level, but with a slight overestimation of the relative humidity. Under this subsaturated air, the simulated rain mixing ratio continuously decreases toward the ground, in agreement with the observations. Conversely, the profiles of the mean volume diameter and the concentration parameter of the DSDs are not well reproduced. These discrepancies pinpoint at an issue in the representation of rain microphysics. The companion paper, investigates the sources of the biases in the microphysics processes in the rain layer by performing numerical sensitivity studies.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗