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DOE OSTI2019

Symmetry restoration in mixed-spin paired heavy nuclei

The nature of the nuclear pairing condensates in heavy nuclei, specifically neutron-proton (spin-triplet), versus identical-particle (spin-singlet) pairing has been an active area of research for quite some time. In this work, we probe three candidates that should display spin-triplet, spin-singlet, and mixed-spin pairing. Using theoretical approaches such as the gradient method and symmetry-restoration techniques, we find the ground state of these nuclei in Hartree–Fock–Bogoliubov theory and compute ground state to ground state pair-transfer amplitudes to neighboring isotopes while simultaneously projecting to specific particle number and nuclear-spin values. We identify specific reactions for future experimental research that could shed light on spin-triplet and mixed-spin pairing.

73 NUCLEAR PHYSICS AND RADIATION PHYSICS↗

DOE OSTI2020

Relativistic hybrid stars with sequential first-order phase transitions and heavy-baryon envelopes

We compute the mass, radius and tidal deformability of stars containing phase transitions from hadronic to quark phase(s). These quantities are computed for three types of hadronic envelopes: purely nuclear, hyperonic, and Δ-resonance--hyperon admixed matter. We consider either a single first-order phase transition to a quark phase with a maximally stiff equation of state (EOS) or two sequential first-order phase transitions mimicking a transition from hadronic to a quark matter phase followed by a second phase transition to another quark phase. We explore the parameter space which produces low-mass twin and triplet configurations where equal-mass stars have substantially different radii and tidal deformabilities. We demonstrate that while for purely hadronic stiff EOS the obtained maximum mass is inconsistent with the upper limit on this quantity placed by GW170817, the inclusion of the hyperonic and Δ-resonance degrees of freedom, as well as the deconfinement phase transition at sufficiently low density, produces a configuration of stars consistent with this limit. The obtained hybrid star configurations are in the mass range relevant for the interpretation of the GW170817 event. We compare our results for the tidal deformability with the limits inferred from GW170817 showing that the onset of non-nucleonic phases, such as Δ-resonance--hyperon admixed phase and/or the quark phase(s), are favored by this data if the nuclear EOS is stiff. Also, we show that low-mass twins and especially triplets proliferate the number of combinations of possible types of stars that can undergo a merger event, the maximal number being six in the case of triplets. The prospects for uncovering the first-order phase transition(s) to and in quark matter via measurements of tidal deformabilities in merger events are discussed.

73 NUCLEAR PHYSICS AND RADIATION PHYSICS↗

DOE OSTI2021

Low-energy Scattering and Effective Interactions of Two Baryons at $m_{\pi}\sim$ 450 MeV from Lattice Quantum Chromodynamics

The interactions between two octet baryons are studied at low energies using lattice QCD (LQCD) with larger-than-physical quark masses corresponding to a pion mass of $m_{\pi}\sim 450$ MeV and a kaon mass of $m_{K}\sim 596$ MeV. The two-baryon systems that are analyzed range from strangeness $S=0$ to $S=-4$ and include the spin-singlet and triplet $NN$, $\Sigma N$ ($I=3/2$), and $\Xi\Xi$ states, the spin-singlet $\Sigma\Sigma$ ($I=2$) and $\Xi\Sigma$ ($I=3/2$) states, and the spin-triplet $\Xi N$ ($I=0$) state. The $s$-wave scattering phase shifts, low-energy scattering parameters, and binding energies when applicable, are extracted using L\"uscher's formalism. While the results are consistent with most of the systems being bound at this pion mass, the interactions in the spin-triplet $\Sigma N$ and $\Xi\Xi$ channels are found to be repulsive and do not support bound states. Using results from previous studies at a larger pion mass, an extrapolation of the binding energies to the physical point is performed and is compared with experimental values and phenomenological predictions. The low-energy coefficients in pionless EFT relevant for two-baryon interactions, including those responsible for $SU(3)$ flavor-symmetry breaking, are constrained. The $SU(3)$ symmetry is observed to hold approximately at the chosen values of the quark masses, as well as the $SU(6)$ spin-flavor symmetry, predicted at large $N_c$. A remnant of an accidental $SU(16)$ symmetry found previously at a larger pion mass is further observed. The $SU(6)$-symmetric EFT constrained by these LQCD calculations is used to make predictions for two-baryon systems for which the low-energy scattering parameters could not be determined with LQCD directly in this study, and to constrain the coefficients of all leading $SU(3)$ flavor-symmetric interactions, demonstrating the predictive power of two-baryon EFTs matched to LQCD.

72 PHYSICS OF ELEMENTARY PARTICLES AND FIELDS↗

DOE OSTI2018

Combination of searches for heavy resonances decaying into bosonic and leptonic final states using 36 fb - 1 of proton-proton collision data at s = 13 TeV with the ATLAS detector

Searches for new heavy resonances decaying into different pairings of W, Z, or Higgs bosons, as well as directly into leptons, are presented using a data sample corresponding to 36.1 fb -1 of pp collisions at $ \sqrt{s}=13 $ TeV collected during 2015 and 2016 with the ATLAS detector at the CERN Large Hadron Collider. Analyses selecting bosonic decay modes in the qqqq, ννqq, ℓνqq, ℓℓqq, ℓνℓν, ℓℓνν, ℓνℓℓ, ℓℓℓℓ, qqbb, ννbb, ℓνbb, and ℓℓbb final states are combined, searching for a narrow-width resonance. Likewise, analyses selecting the leptonic ℓν and ℓℓ final states are also combined. These two sets of analyses are then further combined. No significant deviation from the Standard Model predictions is observed. Three benchmark models are tested: a model predicting the existence of a new heavy scalar singlet, a simplified model predicting a heavy vector-boson triplet, and a bulk Randall-Sundrum model with a heavy spin-2 Kaluza-Klein excitation of the graviton. Cross section limits are set at the 95% confidence level using an asymptotic approximation and are compared with predictions for the benchmark models. These limits are also expressed in terms of constraints on couplings of the heavy vector-boson triplet to quarks, leptons, and the Higgs boson. The data exclude a heavy vector-boson triplet with mass below 5.5 TeV in a weakly coupled scenario and 4.5 TeV in a strongly coupled scenario, as well as a Kaluza-Klein graviton with mass below 2.3 TeV.

72 PHYSICS OF ELEMENTARY PARTICLES AND FIELDS↗

DOE OSTI2017

Origins of Singlet Fission in Solid Pentacene from an ab initio Green’s Function Approach

We develop a new first-principles approach to predict and understand rates of singlet fission with an ab initio Green's-function formalism based on many-body perturbation theory. Starting with singlet and triplet excitons computed from a GW plus Bethe-Salpeter equation approach, we calculate the exciton--bi-exciton coupling to lowest order in the Coulomb interaction, assuming a final state consisting of two non-interacting spin-correlated triplets with finite center-of-mass momentum. For crystalline pentacene, symmetries dictate that the only purely Coulombic fission decay from a bright singlet state requires a final state consisting of two inequivalent nearly degenerate triplets of nonzero, equal and opposite, center-of-mass momenta. For such a process, we predict a singlet lifetime of 40 to 150 fs, in very good agreement with experimental data, indicating that this process can dominate singlet fission in crystalline pentacene. As a result, our approach is general and provides a framework for predicting and understanding multiexciton interactions in solids.

36 MATERIALS SCIENCE↗

DOE OSTI2020

Characterization of NbTi busbar for HL LHC Interaction Region Quadrupoles

The US Accelerator Upgrade for the HiLumi-LHC (US-HL-LHC AUP) project and CERN are designing and fabricating superconducting quadrupole magnets for the interaction regions of the High Luminosity Large Hadron Collider (HLLHC). The triplet is made of three optical elements: Q1, Q2, and Q3. The Nb3Sn quadrupole magnets operate in superfluid He at 1.9 K with a nominal field gradient of 132.6 T/m. The three inner triplet elements are connected together with superconducting buses. The design and fabrication of the through and local buses is carried out at Applied Physics and Superconducting Technology Division (APS-TD) at Fermilab (FNAL). This paper reports the characterization of the bus-bar thermoelectric properties. The bus was tested with a short Nb3Sn magnet (MQXFS1e) in the vertical test facility of the APS-TD at FNAL. The test demonstrated that the bus design is adequate since no spontaneous quench took place up to 17.87 kA current value. Quench propagation velocities were investigated over a range of currents that is typical for accelerator superconducting magnets. Temperature margins were found above that required for the Hi- Lumi triplet bus. The design guarantees the protection of the bus at operational current value according to the quench detection voltage threshold (100 mV) established for the Hi-Lumi LHC interaction region.

43 PARTICLE ACCELERATORS↗

DOE OSTI2020

Intermolecular vibrations mediate ultrafast singlet fission

Singlet fission is a spin-allowed exciton multiplication process in organic semiconductors that converts one spin-singlet exciton to two triplet excitons. It offers the potential to enhance solar energy conversion by circumventing the Shockley-Queisser limit on efficiency. We study the primary steps of singlet fission in a pentacene film by using a combination of TG and 2D electronic spectroscopy complemented by quantum chemical and nonadiabatic dynamics calculations. We show that the coherent vibrational dynamics induces the ultrafast transition from the singlet excited electronic state to the triplet-pair state via a degeneracy of potential energy surfaces, i.e., a multidimensional conical intersection. Significant vibronic coupling of the electronic wave packet to a few key intermolecular rocking modes in the low-frequency region connect the excited singlet and triplet-pair states. Along with high-frequency local vibrations acting as tuning modes, they open a new channel for the ultrafast exciton transfer through the resulting conical intersection.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗

DOE OSTI2018

Optical Spectra of Gamma-Irradiated LiF Crystals with Anisotropic Lithium Nanoparticles

The optical response of Li anisotropic defects and nanoparticles from three faces of cubic LiF crystals with 10-mm edges to γ radiation from a {sup 60}Со source with doses of 10{sup 5}–10{sup 9} R at 320 K in air is studied. After a maximum dose of 10{sup 9} R, scanning electron microscopy revealed submicron metal lithium flakes ordered into long parallel nanofilaments. The resonance absorption band, which shifts from 272 to 295 nm with increasing dose, is assigned to lithium nanocolloids in the (110) plane. The band at 202–225 nm observed only from the (100) face narrows at doses below 10{sup 5} R and is assigned to diatomic fluorine molecules in interstitial sites. The appearance of the 209–212–215-nm triplets at 2.7 × 10{sup 5} R from the (100) plane and the 211–213–215-nm triplets at 0.9 × 10{sup 5} R from the (010) plane is related to radiation-induced axially symmetric bipolarons with a high oscillator strength. The splitting of the 445-nm band into a 438–445–450-nm triplet is observed only for the (010) plane after a dose of 10{sup 6} R and is related to surface plasmon polaritons (longitudinal and transverse) of elongated Li nanoparticles. The (F{sub 2}–F{sub 3}) complexes are oriented in the most imperfect (111) plane and are seen along three cubic axes.

77 NANOSCIENCE AND NANOTECHNOLOGY↗

DOE OSTI2018

Optical Spectroscopy and the Structure of Polyfunctional Hydrocarbon Compounds and Oil Products

The optical and physicochemical properties associated with the change (oxidation, thermolysis and photolysis), during the operation, of the spatial and electronic structures of the polyfunctional hydrocarbon compounds, oils, oil products, and N-, O-, and S-containing heteroaromatic compounds and additives, which comprise a variety of fuel and lubricant compositions involved in the structural and phase rearrangements, as well as in the formation of colloidal and micelle aggregates altering the structure with respect to their hydrocarbon, chemical, and fractional compositions, are investigated. The spectroscopic-luminescent properties of the compounds and their ion-radical forms were studied using optical and spectroscopic methods and quantum-chemical calculations when the excitation energy in the full spectra of singlet and triplet (for the ion, quartet and doublet) electronic excited states was deactivated. Intramolecular mechanisms of the hyperfine electron–nucleus interaction between the active groups of quasi-oscillators in the structure of polyfunctional compounds in the paramagnetic states of hydrocarbons, which form the electronic structure of the triplet–triplet transitions induced by pumping in the optical absorption spectra, are studied. It is shown that the mechanism of multistep ionization, fragmentation, and appearance of radicals and the electronic-vibrational mechanism of an increase in the vibration temperature up to T = 6000–7000 K are developed during the action of the ultraviolet (UV) pumping pulse of a nanosecond duration until the light emission, which gives rise to thermolysis and recombination that create the conditions for the combustion and explosion when the excitation energy is localized on a limited number of groups of quasi-oscillators in the structure.

75 CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND↗

DOE OSTI2022

Tripling down on the W boson mass

A new precision measurement of the W boson mass has been announced by the CDF collaboration, which strongly deviates from the Standard Model prediction. In this article, we study the implications of this measurement on the parameter space of the SU(2) L triplet extension (with hypercharge Y=1) of the Standard Model Higgs sector, focusing on a limit where the new triplet is approximate Z 2 -odd while the SM is Z 2 -even. We study the compatibility of the triplet spectrum preferred by the W boson mass measured by the CDF-II experiment with other electroweak precision observables and Higgs precision data. We comprehensively consider the signals of new Higgs states at the LHC and highlighted the promising search channels. In addition, we also investigate the cosmological implications of the case in which the lightest new Higgs particle is either late decaying or cosmologically stable.

72 PHYSICS OF ELEMENTARY PARTICLES AND FIELDS↗

DOE OSTI2011

Re-visit local coupling correction in the interaction regions of RHIC

In this article we will re-visit the local coupling correction in the interaction regions (IRs) of the Relativistic Heavy Ion Collider (RHIC). We will review the measurement data of triplet quadrupole rolls, the local coupling correction strengths in the RHIC control system, and the methods for the local coupling correction with local skew quadrupole correctors. Based on the in-turnnel measurement data of triplet roll errors in 2011, we will analytically calculate and simulate IR-bump method to find out the local skew correction strengths and compare them at store and at injection with the Blue and Yellow ring lattices in the 2011 polarized proton (p-p) and Au-Au runs. The vertical dispersion from the triplet roll errors, local and global coupling correction skew quadrupoles, and the vertical dipole correctors are calculated and discussed.

43 PARTICLE ACCELERATORS↗

DOE OSTI2011

Re-Visit Local Coupling Correction in the Interaction Regions of RHIC

43 PARTICLE ACCELERATORS↗

DOE OSTI2013

Low Power Upconversion for Solar Fuels Photochemistry

Earth abundant copper(I) diimine complexes represent a renewable and economically feasible alternative to commonly used heavy metal containing chromophores. In the metal-to-ligand charge transfer (MLCT) excited state, copper(I) diimine complexes typically undergo a significant structural rearrangement, leading to molecules with large Stokes shifts and very short excited state lifetimes, thereby limiting their usefulness as sensitizers in bimolecular electron and triplet energy transfer reactions. Strategically placed bulky substituents on the coordinating phenanthroline ligands have proven useful in restricting the transiently produced excited state Jahn-Teller distortion, leading to longer-lived excited states. By combining bulky sec-butyl groups in the 2- and 9- positions with methyl groups in the 3-,4-, 7-, and 8- positions, a remarkably long-lived (2.8 μs in DCM) copper(I) bis-phenanthroline complex, [Cu(dsbtmp)2]+, has been synthesized and characterized. Unlike other copper(I) diimine complexes, [Cu(dsbtmp)2]+ also retains a μs lifetime in coordinating solvents such as acetonitrile and water as a result of the cooperative sterics inherent in the molecular design. Preliminary results on the use of this complex in hydrogen-forming homogeneous photocatalysis is presented. Photon upconversion based on sensitized triplet-triplet annihilation (TTA) represents a photochemical means to generate high-energy photons (or high-energy chemical products) from low-energy excitation, having potential applications in solar energy conversion and solar fuels producing devices. For the first time, synthetically facile and earth abundant Cu(I) MLCT sensitizers have been successfully incorporated into two distinct photochemical upconversion schemes, affording both red-to-green and orange-to-blue wavelength conversions. Preliminary results on aqueous-based photochemical upconversion as well as intramolecular Sn(IV) porphyrins containing axially coordinated aromatic hydrocarbon chromophores poised for upconversion photochemistry are also presented.

14 SOLAR ENERGY↗

DOE OSTI2016

A Theoretical Investigation of the Structure and Reactivity of the Molecular Constituents of Oil Sand and Oil Shale

We used a variety of small organic models of asphaltenes to investigate the molecular mechanism for the high temperature decomposition that would take place as part of the oil refinery process. We determined that the decomposition is initiated via four different types of hydrogen migration reactions. According to the energetics of the reactions, the dominant 1,2-H shift mechanism involves two competitive product channels, namely, C 2 H 2 + CH 2 CS and CS + CH 3 CCH. The minor channels include the formation of CS + CH 2 CCH 2 , H 2 S + C 4 H 2 , HCS + CH 2 CCH, CS + CH 2 CHCH, H + C 4 H 3 S, and HS + C 4 H 3 . We also investigated the alkyl substitution effect by exploring the decomposition pathways of models with alkyl arms. The energetics of such systems were very similar to that for unsubstituted model compounds, which suggests that asphaltene alkylation may not play a significant role in the decomposition of asphaltene compounds. This work was published in the Journal of Physical Chemistry A 2011, 115, 2882-2891. A MECHANISTIC STUDY OF THE 2-THIENYLMETHYL + HO2 RADICAL RECOMBINATION REACTION Radicals are molecules which contain single electrons. They are very reactive. Radical recombination reactions are important in the combustion of fuel oils. Shale oil contains radicals. We used quantum mechanics to explore the reactivity of shale oil model radical compounds. Seventeen product channels corresponding to either addition/elimination or direct hydrogen abstraction were characterized. Direct hydrogen abstraction proceeds via a weakly bonded complex, which leads to 2-methylthiophene, 2-methylene-2,3-dihydrothiophene or 2-methylene-2,5-dihydrothiophene depending upon the 2-thienylmethyl radical reaction site. The addition pathway for the two radical reactants is barrierless with the formation of three adducts, as distinguished by HO 2 reaction at three different sites on the 2-thienylmethyl radical. The addition is exothermic by 37 ~ 55 kcal mol-1 relative to the entrance channel. These excess energies are available to promote further decomposition or rearrangement of the adducts that lead to nascent products such as H, OH, H 2 O and CH 2 O. The reaction surfaces are characterized by relatively low barriers (most are lower than 10 kcal mol-1). Based upon a careful analysis of the overall barrier heights and reaction exothermicities, the formation of O2, OH and H2O is likely to be an important pathway in the radical recombination reactions of 2-thienylmethyl + HO 2 . This work was published in the Journal of Physical Chemistry A, 2011, 115, 14546-14557. REACTION OF THIOPHENE AND METHYLTHIOPHENE WITH SINGLET AND TRIPLET MOLECULAR OXYGEN Mechanisms for the reaction of thiophene and 2-methylthiophene with molecular oxygen on both the triplet and singlet potential energy surfaces (PESs) were investigated using ab initio methods. Thiophene and 2-methylthiophene where shown to react with O 2 via two types of mechanisms; namely, direct hydrogen abstraction and addition/elimination. The barriers for reaction with triplet oxygen are all significantly large (i.e., > 30 kcal mol-1), which indicates that the direct oxidation of thiophene by ground state oxygen might be important only in high temperature processes. Reaction of thiophene with singlet oxygen via a 2+4 cycloaddition leading to endoperoxides is the most favorable channel. Moreover, it was found that alkylation of the thiophene ring (i.e., methyl-substituted thiophene) is capable of lowering the barrier height for the addition pathway. The implication of the current theoretical results may shed new light on the initiation mechanisms for combustion of asphaltenes. This work was published in the Journal of Physical Chemistry A, 2012 116, 4934-4946. JAHN-TELLER STABILIZATION IN POSS CATIONS We have a long standing interest in polyoligomeric silsesquioxane (POSS) molecules. 1-2 These molecules have recently been used as advanced surface coatings for photovoltaic devices and have potential as molecular-based energy storage devices as well as magnetically controllable liquid marbles. 3-5 We have been investigating the small molecule encapsulation properties of POSS and discovered some interesting symmetry breaking processes that need to be better understood in order to use POSS in advanced materials. We have investigated this symmetry breaking mechanism in POSS monocations Si8O12(C(CH3)3)8+ and Si8O12Cl8+, using density functional theory (DFT) and group theory. Under Oh symmetry, these ions possess 2T2g and 2Eg electronic states, respectively, and undergo different symmetry breaking mechanisms. The ground states of Si 8 O 12 (C(CH 3 ) 3 ) 8 + and Si 8 O 12 Cl 8 + belong to the C 3v and D 4h point groups and are characterized by Jahn-Teller stabilization energies of 3959 and 1328 cm-1, respectively, at the B3LYP/def2-SVP level of theory. The symmetry distortion mechanism in Si 8 O 12 Cl 8 + is Jahn-Teller type, whereas in Si 8 O 12 (C(CH 3 ) 3 ) 8 + the distortion is a combination of both Jahn-Teller and pseudo-Jahn-Teller effects. The distortion force acting in Si 8 O 12 (C(CH 3 ) 3 ) 8 + is mainly localized on one Si-(tert-butyl) group while in Si 8 O 12 Cl 8 + it is distributed over the oxygen atoms. The main distortion forces acting on the Si8O12 core arise from the coupling between the electronic state and the vibrational modes; identified as 9t 2g +1e g +3a 2u for the Si 8 O 12 (C(CH 3 ) 3 ) 8 + and 1e g +2e g for Si 8 O 12 Cl 8 + . This work was published in the Journal of Physical Chemistry A, 2015, 119, 4237-4243.

04 OIL SHALES AND TAR SANDS↗

DOE OSTI2020

U.S. HL-LHC Accelerator Upgrade Project: Q1/Q3 Cryostat Assembly and Horizontal Test (Final Design Report)

The Inner Triplet (IT) quadrupoles are the magnetic system for reaching low beta functions around the Interaction Point (IP). The triplet is made of three optical elements: Q1, Q2, and Q3. The upgrade of the Inner Triplets in the high luminosity insertions is the cornerstone of the LHC upgrade. The decision for HL-LHC heavily relies on the success of the advanced Nb 3 Sn technology that provides access to magnetic fields well beyond 9 T, allowing the maximization of the aperture of the IT quadrupoles. A 15-year-long study led by the DOE in the US under the auspices of the U.S. LARP program, and lately by other EU programs, has shown the feasibility of Nb 3 Sn accelerator magnets. The HL-LHC is expected to be the first application of accelerator-quality Nb 3 Sn magnet technology in an operating particle accelerator.

72 PHYSICS OF ELEMENTARY PARTICLES AND FIELDS↗

DOE OSTI2023

Multifunctional Optical Outcouplers for Efficient and Stable White OLEDs (Final Technical Report)

Replacing fluorescence by phosphorescence in OLED-based solid-state lighting can realize the Department of Energy’s efficiency target of 83% Internal Quantum Efficiency (IQE). The principal challenge, however, is to fix the poor stability of phosphorescent blue OLEDs. To address this, we have fabricated novel plasmonic architectures that improve device stability by decreasing the exciton lifetime of the emitters without drastically decreasing the light extraction efficiency. We describe the impact on stability of these structures in high efficiency blue phosphorescent OLEDs. Although the benefit is appreciable, we find that targeting ‘bright’ triplets on phosphorescent emitter molecules is an incomplete solution, and that it is also necessary to stabilize ‘dark’ triplets formed in the host and blocking layers. We demonstrate substantial improvements in stability using the latter approach, and conclude with a discussion of potential approaches to managing dark triplets in OLEDs.

32 ENERGY CONSERVATION, CONSUMPTION, AND UTILIZATI↗

DOE OSTI2017

Multi-wavelength Spectral Analysis of Ellerman Bombs Observed by FISS and IRIS

Ellerman bombs (EBs) are a kind of solar activity that is suggested to occur in the lower solar atmosphere. Recent observations using the Interface Region Imaging Spectrograph (IRIS) show connections between EBs and IRIS bombs (IBs), which imply that EBs might be heated to a much higher temperature (8 × 10{sup 4} K) than previous results. Here we perform a spectral analysis of EBs simultaneously observed by the Fast Imaging Solar Spectrograph and IRIS. The observational results show clear evidence of heating in the lower atmosphere, indicated by the wing enhancement in H α , Ca ii 8542 Å, and Mg ii triplet lines and also by brightenings in images of the 1700 Å and 2832 Å ultraviolet continuum channels. Additionally, the intensity of the Mg ii triplet line is correlated with that of H α when an EB occurs, suggesting the possibility of using the triplet as an alternative way to identify EBs. However, we do not find any signal in IRIS hotter lines (C ii and Si iv). For further analysis, we employ a two-cloud model to fit the two chromospheric lines (H α and Ca ii 8542 Å) simultaneously, and obtain a temperature enhancement of 2300 K for a strong EB. This temperature is among the highest of previous modeling results, albeit still insufficient to produce IB signatures at ultraviolet wavelengths.

79 ASTRONOMY AND ASTROPHYSICS↗

NASA NTRS1975

The ground state properties of spin-aligned atomic hydrogen, deuterium, and tritium

The internal energy, pressure, and compressibility of ground-state, spin-aligned atomic hydrogen, deuterium, and tritium are calculated assuming that all pair interactions occur via the atomic triplet (spin-aligned) potential. The conditions required to obtain atomic hydrogen and its isotopes in bulk are discussed; such a development would be of value in propulsion systems because of the light mass and energetic recombination of atomic hydrogen. Results show that atomic triplet hydrogen and deuterium remain gaseous at 0 K, and that tritium forms a liquid with a binding energy of approximately -0.75 K per atom at a molar volume of 130 cu cm per mole. The pair distribution function for these systems is calculated, and the predicted superfluid behavior of atomic triplet hydrogen and tritium is briefly discussed.

Etters, R. D.↗