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NASA NTRS1986

Global dynamics and thermal structure of Jupiter's atmosphere

Voyager flyby observations have yielded the first detailed maps of wind and temperature fields in the Jupiter atmosphere; these data indicate that Jupiter's zonal currents violate the barotropic instability criterion if they extend only a few scale heights below the cloud tops. Microwave observations at mm and cm wavelengths have probed the atmosphere down to a level of about 7 bars, thereby constraining horizontal and vertical thermal structure in a region of the atmosphere about which little was known. Temporal variations in the temperature field suggest that dynamical processes may be important in the establishment of tropopause structure on short time scales. Ground-based and Voyager observations have also indicated a hemispheric asymmetry in temperature in the upper stratosphere.

Flasar, F. M.↗

NASA NTRS1986

Global dynamics and thermal structure of Jupiter's atmosphere

Flasar, F. M.↗

NASA NTRS1992

The broad emission line and continuum variations of Seyfert galaxies. I - Time scales and amplitudes

Spectroscopic observations of 13 Seyfert 1 galaxies made from 1979 to 1984 at Palomar and Steward Observatories were analyzed for Balmer-line and optical continuum variability. The majority of the galaxies showed significant variations, particularly in the continuum. Typical peak-to-peak changes for H-beta and H-gamma integrated line fluxes were 100-200 percent, while the continua varied by 200-350 percent. In several cases, Balmer-line and continuum variations were found to be strongly correlated, as expected for photoionization by a central continuum source. However, these correlations were found to be highly nonlinear. Significant correlations were found between variability amplitude and global AGN properties such as luminosity. Moreover, a significant number of variations occurring on short time scales constrains the size of the broad-line region in Seyfert galaxies to about 90 lt-days across or less.

Rosenblatt, Edward I.↗

NASA NTRS1994

Neptune's inner magnetosphere and aurora: Energetic particle constraints

A dramatic and peculiar dropout of greater than 500-keV ions (but not electrons) was observed within Neptune's inner magnetosphere near 2 R(sub N) as the Voyager 2 spacecraft approached the planet. Unlike a number of other energetic particle features this feature could not be accounted for by known material bodies in the context of the most utilized magnetic field models (neither the offset tilted dipole models nor the spehrical harmonic model 'O8'). However, the configuration of Neptune's inner magnetosphere is highly uncertain. By applying a novel technique, utilizing energetic particle measurements, to constrain the magnetic field configuration of the inner regions, we show that appeals to unobserved materials within Neptune's system are unnecessary, and that the ion dropout feature was, in all likelihood, the result of ion interactions with maximum L excursions of the ring 1989N1R. The constraints also favor the se of the M2 magnetic field model (Selesnick, 1992) over the previous models. An electron feature was probably absent because the electron interactions with the ring occurred substantially before the ion interactions (about 2 hours for the electrons versus a few minutes for the ions). Pitch-angle scattering apparently eliminated the electron signature. Minimum scattering rates determined based on this premise yield enough electron precipitation power to explain the brightest component of Neptune's aurora. We propose that this bright component is analogous to the Earth's diffuse aurora.

Mauk, B. H.↗

NASA NTRS1997

Reduction of EUVE Guest Observer Data

We report on the observation of the HI filament LVC 88+36-2 with the Deep Survey/Spectrometers of EUVE. Detecting the shadow of this cloud in absorption might have proven the existence of a diffuse EUV background behind the cloud, and constrain the emission geometries of the hot plasma in the Local Interstellar Medium (LISM). By detecting diffuse emission in the EUVE spectrometers, it would also be possible to constrain the temperature and pressure of the emitting regions as well as determine whether or not the hot phase of the LISM is in equilibrium with cosmic elemental abundances. Unfortunately, we did not detect a cloud shadow with this set of observations. This is due to a combination of circumstances, but mostly due to the fact that EUV diffuse emission is weak compared to the background levels of EUVE. If a shadow exists in the EUVE, then it is less than 1% of the EUVE detector background of 1e-3 cts arcmin(exp -2) in the Deep Survey detector.

Vallerga, John↗

NASA NTRS1997

Reduction of EUVE Guest Observer Data

This report documents the observations of the HI filament LVC 88+36-2 with the Deep Survey/Spectrometers of EUVE. Detecting the shadow of this cloud in absorption might have proven the existence of a diffuse EUV background behind the cloud, and constrain the emission geometries of the hot plasma in the Local Interstellar Medium (LISM). By detecting diffuse emission in the EUVE spectrometers, it would also be possible to constrain the temperature and pressure of the emitting regions as well as determine whether or not the hot phase of the LISM is in equilibrium with cosmic elemental abundances. Unfortunately, we did not detect a cloud shadow with this set of observations. This is due to a combination of circumstances, but mostly due to the fact that EUV diffuse emission is weak compared to the background levels of EUVE. If a shadow exists in the EUVE, then it is less than 1% of the EUVE detector background of 1e-3 cts arcmin(sup -2) in the Deep Survey detector.

Vallerga, John↗

NASA NTRS1998

The Postshock Chemical Lifetimes of Outflow Tracers and a Possible New Mechanism to Produce Water Ice Mantles

We have used a coupled time-dependent chemical and dynamical model to investigate the lifetime of the chemical legacy in the wake of C-type shocks. We concentrate this study on the chemistry of H2O and O2, two molecules which are predicted to have abundances that are significantly affected in shock-heated gas. Two models are presented: (1) a three-stage model of preshock, shocked, and postshock gas; and (2) a Monte Carlo cloud simulation where we explore the effects of stochastic shock activity on molecular gas over a cloud lifetime. For both models we separately examine the pure gas-phase chemistry as well as the chemistry including the interactions of molecules with grain surfaces. In agreement with previous studies, we find that shock velocities in excess of 10 km/s are required to convert all of the oxygen not locked in CO into H2O before the gas has an opportunity to cool. For pure gas phase models the lifetime of the high water abundances, or "H2O legacy," in the postshock gas is approximately (4-7) x 10(exp 5) yr, independent of the gas density. A density dependence for the lifetime of H2O is found in gas-grain models as the water molecules deplete onto grains at the depletion timescale. Through the Monte Carlo cloud simulation we demonstrate that the time-average abundance of H2O, the weighted average of the amount of time gas spends in preshock, shock, and postshock stages, is a sensitive function of the frequency of shocks. Thus we predict that the abundance of H2O, and to a lesser extent O2, can be used to trace the history of shock activity in molecular gas. We use previous large-scale surveys of molecular outflows to constrain the frequency of 10 km/s shocks in regions with varying star formation properties and discuss the observations required to test these results. We discuss the postshock lifetimes for other possible outflow tracers (e.g., SiO and CH3OH) and show that the differences between the lifetimes for various tracers can produce potentially observable chemical variations between younger and older outflows. For gas-grain models we find that the abundance of water-ice on grain surfaces can be quite large and is comparable to that observed in molecular clouds. This offers a possible alternative method to create water mantles without resorting to grain surface chemistry: gas heating and chemical modification due to a C-type shock and subsequent depletion of the gas-phase species onto grain mantles.

Bergin, Edwin A.↗

NASA NTRS2004

Petrogenesis of Mare Basalts, Mg-Rich Suites and SNC Parent Magmas

The successful models for the internal evolution of the Moon must consider the volume, distribution, timing, composition and, ultimately, the petrogenesis of mare basaltic volcanism. Indeed, given the paucity of geophysical data, the internal state of the Moon in the past can be gleaned only be unraveling the petrogenesis of the various igneous products on the Moon and, particularly, the mare basalts. most useful in constraining the depth and composition of their source region [Delano, 1980] despite having undergone a certain degree of shallow level olivine crystallization.The bulk of the lunar volcanic glass suite can be modeled as the partial melting products of an olivine + orthopyroxene source region deep within the lunar mantle. Ti02 contents vary from 0.2 wt % -1 7.0wt [Shearer and Papike, 1993]. Values that extreme would seem to require a Ti- bearing phase such as ilmenite in the source of the high-Ti (but not in the VLT source) because a source region of primitive LMO olivine and orthopyroxene, even when melted in small degrees cannot account for the observed range of Ti02 compositions. The picritic glasses are undersaturated with respect to ilmenite at all pressures investigated therefore ilmenite must have been consumed during melting, leaving an ilmenite free residue and an undersaturated melt [Delano, 1980, Longhi, 1992, Elkins et al, 2000 among others]. Multi- saturation pressures for the glasses potentially represent the last depths at which the liquids equilibrated with a harzburgite residue before ascending to the surface. These occur at great depths within the lunar mantle. Because the liquids have suffered some amount of crystal fractionation, this is at best a minimum depth. If the melts are mixtures, then it is only an average depth of melting. Multisaturation, nevertheless, is still a strong constraint on source mineralogy, revealing that the generation of the lunar basalts was dominated by melting of olivine and orthopyroxene.

Hess, Paul C.↗

NASA NTRS2008

Climate Quality Broadband and Narrowband Solar Reflected Radiance Calibration Between Sensors in Orbit

vAs the potential impacts of global climate change become more clear [1], the need to determine the accuracy of climate prediction over decade-to-century time scales has become an urgent and critical challenge. The most critical tests of climate model predictions will occur using observations of decadal changes in climate forcing, response, and feedback variables. Many of these key climate variables are observed by remotely sensing the global distribution of reflected solar spectral and broadband radiance. These "reflected solar" variables include aerosols, clouds, radiative fluxes, snow, ice, vegetation, ocean color, and land cover. Achieving sufficient satellite instrument accuracy, stability, and overlap to rigorously observe decadal change signals has proven very difficult in most cases and has not yet been achieved in others [2]. One of the earliest efforts to make climate quality observations was for Earth Radiation Budget: Nimbus 6/7 in the late 1970s, ERBE in the 1980s/90s, and CERES in 2000s are examples of the most complete global records. The recent CERES data products have carried out the most extensive intercomparisons because if the need to merge data from up to 11 instruments (CERES, MODIS, geostationary imagers) on 7 spacecraft (Terra, Aqua, and 5 geostationary) for any given month. In order to achieve climate calibration for cloud feedbacks, the radiative effect of clear-sky, all-sky, and cloud radiative effect must all be made with very high stability and accuracy. For shortwave solar reflected flux, even the 1% CERES broadband absolute accuracy (1-sigma confidence bound) is not sufficient to allow gaps in the radiation record for decadal climate change. Typical absolute accuracy for the best narrowband sensors like SeaWiFS, MISR, and MODIS range from 2 to 4% (1-sigma). IPCC greenhouse gas radiative forcing is approx. 0.6 W/sq m per decade or 0.6% of the global mean shortwave reflected flux, so that a 50% cloud feedback would change the global reflected flux by approx. 0.3 W/sq m or 0.3% per decade in broadband SW calibration change. Recent results comparing CERES reflected flux changes with MODIS, MISR, and SeaWiFS narrowband changes concluded that only SeaWiFS and CERES were approaching sufficient stability in calibration for decadal climate change [3]. Results using deep convective clouds in the optically thick limit as a stability target may prove very effective for improving past data sets like ISCCP. Results for intercalibration of geostationary imagers to CERES using an entire month of regional nearly coincident data demonstrates new approaches to constraining the calibration of current geostationary imagers. The new Decadal Survey Mission CLARREO is examining future approaches to a "NIST-in-Orbit" approach of very high absolute accuracy reference radiometers that cover the full solar and infrared spectrum at high spectral resolution but at low spatial resolution. Sampling studies have shown that a precessing CLARREO mission could calibrate other geo and leo reflected solar radiation and thermal infrared sensors.

Wielicki, Bruce A.↗

NASA NTRS2013

A Global Model of Meteoric Sodium

A global model of sodium in the mesosphere and lower thermosphere has been developed within the framework of the National Center for Atmospheric Research's Whole Atmosphere Community Climate Model (WACCM). The standard fully interactive WACCM chemistry module has been augmented with a chemistry scheme that includes nine neutral and ionized sodium species. Meteoric ablation provides the source of sodium in the model and is represented as a combination of a meteoroid input function (MIF) and a parameterized ablation model. The MIF provides the seasonally and latitudinally varying meteoric flux which is modeled taking into consideration the astronomical origins of sporadic meteors and considers variations in particle entry angle, velocity, mass, and the differential ablation of the chemical constituents. WACCM simulations show large variations in the sodium constituents over time scales from days to months. Seasonality of sodium constituents is strongly affected by variations in the MIF and transport via the mean meridional wind. In particular, the summer to winter hemisphere flow leads to the highest sodium species concentrations and loss rates occurring over the winter pole. In the Northern Hemisphere, this winter maximum can be dramatically affected by stratospheric sudden warmings. Simulations of the January 2009 major warming event show that it caused a short-term decrease in the sodium column over the polar cap that was followed by a factor of 3 increase in the following weeks. Overall, the modeled distribution of atomic sodium in WACCM agrees well with both ground-based and satellite observations. Given the strong sensitivity of the sodium layer to dynamical motions, reproducing its variability provides a stringent test of global models and should help to constrain key atmospheric variables in this poorly sampled region of the atmosphere.

meteoric flux↗

NASA NTRSDate not supplied

4.32 Billion Year Old Impact Melts at Apollo 14: Dating the Procellarum Basin?

Introduction: Recent work has improved our understanding of lunar crustal structure and basin evolution on the Moon, but its early impact history and implications for solar system dynamics remain poorly established [1,2]. In particular, there is a derth of absolute ages, especially for the period >4.0 Ga, that could be related to basin-forming events. Here we present U-Pb isotopic data for Zr-rich minerals found in impact-melt fragments from Apollo 14 soil sample 14163 that, when combined with previously published data, dates an impact event at 4324±15 Ma. The compositions and ages of these impact-melt fragments provide unique information about the timing of early impact events and the composition of the lunar crust. Results: Fourteen rocklets ranging in size from 1 to 3 mm were extracted from soil 14163. Most are impactmelt rocks with 10-30% clasts of mostly pyroxene and plagioclase (100 to 500 μm) in a crystalline matrix. Textures of the matrix vary from subophitic, formed by intergrowths of 10-20 μm plagioclase and pyroxene crystals, to poikilitic, with plagioclase and pyroxene reaching 20-50 μm size. Some fragments that contain no visible clasts have similar textures are also interpreted as impact-melt rocks. All fragments contain notably large proportions of euhedral to subhedral ilmenite, zircon, apatite/merrillite and less abundant zirconolite and baddeleyite in the melt matrices. These grains often form intricate intergrowths with each other and rock-forming minerals, indicating their crystallization from the melt (Fig. 1). However, some slightly larger (~50 μm) zircon and phosphate grains can be interpreted as relict clasts based on their granular textures and relationships with the surrounding phases (Fig. 1). This implies that zircon and phosphate minerals were present in the target rocks. Some of these grains were profoundly remelted during the impact, which resulted in an oversaturation of the melt in Zr and P and crystallization of new grains of Zrrich minerals and phosphates during melt solidification. The presence of zircon and phosphates indicates that the melts were significantly enriched in KREEP components and ties their provenance to the Procellarum- KREEP Terrane (PKT) [3]. Combined U-Pb zircon data obtained for all fragments form two main clusters on a concordia diagram (Fig. 2), between about 4.3 and 3.9 Ga. Phosphate data mostly concentrate on the younger end of this age range but some analyses are almost as old as the older zircon grains (Fig. 2). Figure 1: Zircon (Zr) and phosphate (Apt; Mer) grains in impact melt fragments from Apollo 14 soil 14161. A-zircon grains crystallized from impact melt; B-phosphate grain inherited from the target; C- granular zircon grains Our interpretation of these data is that all U-rich minerals experienced variable resetting of the U-Pb system, with phosphate, where closure temperature is significantly lower than that in zircon, affected more profoundly by Pb loss than zircon. Our best estimate of the time of formation of zircon and phosphate is based on statistically valid analysis of grains interpreted texturally as grown from the impact melt (Fig. 2). Ten of these analyses define an age of 4324±15 Ma (MSWD=3.0, probability of fit P=0.002). Our best estimate for the time of resetting is obtained by combining data from phosphates that are statistically indistinguishable from 3.9 Ga within the analytical uncertainties. This group is represented by 18 analyses of 15 phosphate grains from different fragments (Fig. 2) and defines an age of 3922±6 Ma (MSWD=1.2, P=0.23). Conversely, a minimum age of the target lithologies, remelted in the impact that produced the rocklets studied here (Fig. 2), can be determined from the five oldest analyses of zircon clasts at 4338±13 Ma (MSWD=1.5, P=0.2), which is indistinguishable from the age of the impact melt within the uncertainties. The obtained ages, combined with textural evidence, imply that the impact melt was formed at 4324±15 Ma, and that it occurred in a zircon-rich target with a minimum age of 4338±13 Ma. Further reworking occurred during a second impact event at 3922±6 Ma. Discussion: The younger age of 3922±6 Ma can be interpreted as the time of the Imbrium impact. The older age of 4324±15 Ma would then be the time of formation of the impact melt, which was then caught in the Imbrium ejecta either at the Apollo 14 landing site or within the target rocks of the Imbrium impact. The presence of abundant accessory phases such as zircons and phosphates is consistent with a substantial KREEP component in the analyzed particles. The current distribution of KREEP on the lunar surface appears to be strongly influenced by Imbrum ejecta [4] so interpretation of the 4.32 Ga age depends in part on assumed structure of the pre-impact crust and distribution of KREEP within the crust. If KREEP was present only in the deep crust at 4.32 Ga, then a basin-scale impact possibly analogous to Imbrium or larger may be necessary to excavate a KREEPy impact melt at this time. However, if KREEPy materials were present closer to the surface perhaps due to redistribution related to Mg-suite magmatism, then smaller impacts might be able to rework KREEPy compositions at shallower depths. The coherence of the data on the particles analysed here suggests a large volume of melt that has been preserved since 4.32 Ga, consistent with a large impact event. Relict zircons and mineral clasts suggests that the igneous crust in the vicinity of this impact was well developed by at least 4.34 Ga, similar to the model age of KREEP and older than the isochron ages of many Mg-suite cumulates [5]. A problem that confronts all lunar sample studies using the current collection is that the pre-Imbrium geology of the PKT (the source of these 4.32 Ga impact melts) is not well constrained. The South Pole-Aitken basin contains regions that are moderately enriched in Th, but its ejecta is Th-poor [6]; therefore these A14 fragments are probably not SPA ejecta. Alternatively, these fragments may represent formation of a hypothesized Procellarum basin [7] although the lack of a clearly defined basin ejecta signature is a potential problem with that interpretation. In any case, they provide a younger limit on the age of lunar differentiation and formation of KREEP within the lunar crust. Figure 2: U-Pb data for zircon and phosphate grains from impact melt fragments. A-all data; B-data used for age calculations. References: [1] Orgel C., Michael G., Fassett C. I., van der Bogert C. H., Riedel C., Kneissl T., and Hiesinger H. (2018) J. Geophys. Res. Planets 123, 748- 762. [2] Evans A. J., Andrews-Hanna J. C., Head J. W., Soderblom J. M., Solomon S. C., and Zuber M. T. (2018) J. Geophys. Planets. 123, 1596-1617. [3] Jolliff, B.L., Gillis, J.J., Haskin, L.A., Korotev, R.L. and Wieczorek, M.A. (2000) J. Geophys. Res: Planets 105, 4197-4216. [4] Haskin L. A. (1998) J. Geophys. Res. Planets 103, 1679-1689. [5] Borg L.E., Gaffney A.M., and Shearer C.K. (2015) MAPS 50, 715-732. [6] Moriarty, D.P., Watkins, R.N., Valencia, S.N., Kendall, J.D., Evans, A.J., Dygert, N. and Petro, N.E. (2021) J. Geophys. Res. Planets 126. [7] Zhu, M.H., Wünnemann, K., Potter, R.W., Kleine, T. and Morbidelli, A. (2019) J. Geophys. Res: Planets 124, 2117-2140

M D Norman↗

NASA NTRS1992

X-ray constraints on the shape of the dark matter in five Abell clusters

X-ray observations obtained with the Einstein Observatory are used to constrain the shape of the dark matter in the inner regions of Abell clusters A401, A426, A1656, A2029, and A2199, each of which exhibits highly flattened optical isopleths. The dark matter is modeled as an ellipsoid with a mass density of about r exp -2. The possible shapes of the dark matter is constrained by comparing these model isophotes to the image isophotes. The X-ray isophotes, and therefore the gravitational potentials, have ellipticities of about 0.1-0.2. The dark matter within the central 1 Mpc is found to be substantially rounder for all the clusters. It is concluded that the shape of the galaxy distributions in these clusters traces neither the gravitational potential nor the gravitating matter.

Buote, David A.↗

NASA NTRS2020

Differences in Tropical High Clouds Among Reanalyses: Origins and Radiative Impacts

We examine differences among reanalysis highcloud products in the tropics, assess the impacts of these differences on radiation budgets at the top of the atmosphere and within the tropical upper troposphere and lower stratosphere (UTLS), and discuss their possible origins in the context of the reanalysis models. We focus on the ERA5 (fifthgeneration European Centre for Medium-range Weather Forecasts – ECMWF – reanalysis), ERA-Interim (ECMWF Interim Reanalysis), JRA-55 (Japanese 55-year Reanalysis), MERRA-2 (Modern-Era Retrospective Analysis for Research and Applications, Version 2), and CFSR/CFSv2 (Climate Forecast System Reanalysis/Climate Forecast System Version 2) reanalyses. As a general rule, JRA-55 produces the smallest tropical high-cloud fractions and cloud water contents among the reanalyses, while MERRA-2 produces the largest. Accordingly, long-wave cloud radiative effects are relatively weak in JRA-55 and relatively strong in MERRA-2. Only MERRA-2 and ERA5 among the reanalyses produce tropical-mean values of outgoing long-wave radiation (OLR) close to those observed, but ERA5 tends to underestimate cloud effects, while MERRA-2 tends to overestimate variability. ERA5 also produces distributions of longwave, short-wave, and total cloud radiative effects at the top of the atmosphere that are very consistent with those observed. The other reanalyses all exhibit substantial biases in at least one of these metrics, although compensation between the long-wave and short-wave effects helps to constrain biases in the total cloud radiative effect for most reanalyses. The vertical distribution of cloud water content emerges as a key difference between ERA-Interim and other reanalyses. Whereas ERA-Interim shows a monotonic decrease of cloud water content with increasing height, the other reanalyses all produce distinct anvil layers. The latter is in better agreement with observations and yields very different profiles of radiative heating in the UTLS. For example, whereas the altitude of the level of zero net radiative heating tends to be lower in convective regions than in the rest of the tropics in ERAInterim, the opposite is true for the other four reanalyses. Differences in cloud water content also help to explain systematic differences in radiative heating in the tropical lower stratosphere among the reanalyses. We discuss several ways in which aspects of the cloud and convection schemes impact the tropical environment. Discrepancies in the vertical profiles of temperature and specific humidity in convective regions are particularly noteworthy, as these variables are directly constrained by data assimilation, are widely used, and feed back to convective behaviour through their relationships with thermodynamic stability.

High Clouds↗

NASA NTRS2013

Evidence of a Discontinuous Disk Structure Around the Herbig Ae Star HD 139614

The formation and evolution of a planetary system are intrinsically linked to the evolution of the primordial accretion disk and its dust and gas content. A new class of pre-main sequence objects has been recently identified as pre-transitional disks. They present near-infrared excess coupled to a flux deficit at about 10 microns and a rising mid-infrared and far-infrared spectrum. These features suggest a disk structure with inner and outer dust components, separated by a dust-depleted region (or gap). This could be the result of particular planet formation mechanisms that occur during the disk evolution. We here report on the first interferometric observations of the disk around the Herbig Ae star HD 139614. Its infrared spectrum suggests a flared disk, and presents pre-transitional features, namely a substantial near-infrared excess accompanied by a dip around 6 microns and a rising mid-infrared part. In this framework, we performed a study of the spectral energy distribution (SED) and the mid-infrared VLTI/MIDI interferometric data to constrain the spatial structure of the inner dust disk region and assess its possibly multi-component structure. We based our work on a temperature-gradient disk model that includes dust opacity.While we could not reproduce the SED and interferometric visibilities with a one-component disk, a better agreement was obtained with a two-component disk model composed of an optically thin inner disk extending from 0.22 to 2.3 AU, a gap, and an outer temperature-gradient disk starting at 5.6 AU. Therefore, our modeling favors an extended and optically thin inner dust component and in principle rules out the possibility that the near-infrared excess originates only from a spatially confined region. Moreover, the outer disk is characterized by a very steep temperature profile and a temperature higher than 300 K at its inner edge. This suggests the existence of a warm component corresponding to a scenario where the inner edge of the outer disk is directly illuminated by the central star. This is an expected consequence of the presence of a gap, thus indicative of a "pre-transitional" structure.

primordial accretion disk↗

DOE OSTI2022

Testing horndeski gravity with S2 star orbit

ABSTRACT We have explored a completely new and alternative way to restrict the parameter space of Horndeski theory of gravity. Using its Newtonian limit, it is possible to test the theory at a regime where, given its complexity and the small magnitude of the expected effects, it is poorly probed. At Newtonian level, it gives rise to a generalized Yukawa-like Newtonian potential which we have tested using S2 star orbit data. Our model adds five parameters to the General Relativity model, and the analysis constrains two of them with unprecedented precision to these energy scales, while it only gives an exclusion region for the remaining parameters. We have shown the potential of weak-field tests to constrain Horndeski gravity opening, as a matter of fact, which is a new avenue that deserves to be further, and deeply, explored in the near future.

Della Monica, R. (ORCID:0000000238429297)↗

DOE OSTI2026

EvoDiffMol: evolutionary diffusion framework for 3D molecular design with optimized properties

Designing molecules with specific target properties remains a fundamental challenge in computational chemistry. While existing approaches show promise, most rely on simplified representations like SMILES strings or 2D graphs that lack essential three-dimensional geometric information. We present EvoDiffMol, a computational framework that integrates evolutionary algorithms with three-dimensional diffusion models for property-driven molecular generation. The method operates through adaptive evolutionary optimization, where population-based selection guides the generation process toward desired property landscapes. EvoDiffMol supports both unconstrained molecular design and scaffold-constrained generation that preserves fixed substructures while optimizing complementary regions. Comprehensive evaluation demonstrates exceptional performance, achieving the highest drug-likeness score (0.94) among all compared state-of-the-art methods while maintaining excellent validity, uniqueness, and novelty. Beyond single property optimization, the framework demonstrates flexible multi-property optimization capabilities, simultaneously controlling multiple molecular descriptors including synthetic accessibility, lipophilicity, topological polar surface area, and clinically relevant ADMET properties such as cardiotoxicity (hERG) and intestinal permeability (Caco-2). This adaptability spans from simple descriptors to practical pharmaceutical endpoints without requiring complete model retraining. The framework achieves precise control over target property values, generating molecules with properties closely matching specified targets for both single and multiple descriptors. Scaffold-constrained experiments preserve fixed molecular cores while maintaining effective property optimization. The three-dimensional representation offers advantages in maintaining structural validity during iterative optimization, with potential for geometry-aware applications in materials science and drug discovery.

3D molecular generation↗

DOE OSTI2020

Atmospheric ice nuclei concentration measurements over a high altitude-station in the Western Ghats, India

Mixed-phase and ice clouds play a significant role in modulating the Indian summer monsoon rainfall, and modeling studies suggest that inaccurate representation of ice nucleating particles (INP) is one of the factors, which have resulted in a deficiency in the prediction of cloud properties and hydrological cycle. We do not understand the ice nucleation mechanisms to represent the ice formation in the model, and therefore more INP measurements at various supercooled temperatures are needed. This study reports for the first time real-time INP concentration at a high altitude station in the Western Ghats region of India, and these results will be used to constrain the ice nucleation parameterizations in the model. The variation of INP for any particular cloud condition can have strong microphysical responses of mixed-phase precipitation formation processes. Also, to improve the representation of heterogeneous ice nucleation, INP measurements of various types of aerosols commonly observed over the Indian region are needed. This study presents, the INP concentrations and daily concentration of non-refractory chemical composition (organics, sulfate, nitrate, ammonium, and chloride), cloud condensation nuclei (CCN), and aerosol size distribution. Spectrometer for Ice Nuclei (SPIN) was operated to measure INP concentration at the mountain site from August to December 2018. INP measurements were performed at three different temperatures (-25, -30, and - 34 °C) in the immersion freezing mode relevant for mixed-phase cloud conditions. The average INP concentrations approximately varied from 0.18 to 12.4 L-1, 0.39 to 24 L-1, 1.1 to 40.2 L-1 at -25, -30, and - 34 °C, respectively. These concentrations are within the concentrations reported in the literature from different regions across the globe. The air mass back trajectory analysis showed that continental air mass contains more INP compared to maritime air mass. The information on INP concentration and chemical characteristics of aerosol will help to improve heterogeneous ice nucleation parameterization in numerical models.

Kumar, Anil V.↗

NASA NTRS2004

Evidence for a Wet, Reduced Martian Interior

Knowledge of the oxygen fugacity and hydrogen content of the source regions of martian meteorites is of paramount importance in constraining phase equilibria, crystallization sequences, and geodynamic processes of the martian interior, as well as models of the planet's evolution. To date, these interpretations have been hindered by the paucity in SNC meteorites of Fe-Ti oxides used in conventional oxybarometry, and by the presence of secondary alteration products that make it impossible to quantify primary hydrogen abundances in SNC minerals and melts based on whole rock samples. We present here the first transmission FTIR spectra of individual mineral grains from SNC meteorites, and interpret those results along with Mossbauer data on mineral separates from the same meteorites. Our goal is to quantify the amount of water and the oxygen fugacity present in the source regions for the rocks comprising the meteorites.

Dyar, M. D.↗