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Chen, Jun

Publications and source records attributed to Chen, Jun.

At least 19 records
All sourcesNASA NTRSDOE OSTI
DOE OSTI2025

Identifying a next-generation antimalarial trioxolane in a landscape of artemisinin partial resistance

For over two decades, artemisinin-based combination therapy (ACT) has been the standard of care for the treatment of uncomplicated falciparum malaria. However, artemisinin partial resistance (ART-R) is now prevalent in Southeast Asia and has emerged in eastern Africa, threatening ACT efficacy. Artefenomel, a synthetic 1,2,4-trioxolane, exhibits an extended pharmacokinetic exposure profile that predicts for efficacy against ART-R parasites. Unfortunately, the development of artefenomel was halted recently after almost a decade in the clinic. Here, we describe studies of an artefenomel-adjacent chemotype that combines potent in vitro activity against clinical ART-R parasites, an extended pharmacokinetic profile with single-exposure efficacy in a murine malaria model, and enhanced stability in human microsomes and hepatocytes. Overall, our studies reveal a heretofore underexplored trioxolane chemotype with the potential to address ART-R in a next-generation trioxolane development candidate.

Science & Technology - Other Topics↗
DOE OSTI2024

Superior Piezo-/Ferro-Electricity in Antiferroelectric Ag x NbO 3-δ Thin Films by Nanopillar Local Structure Design

Antiferroelectrics are fundamental mother compounds critical in developing innovative lead-free piezoelectrics and ferroelectrics and hold great promise for wide-ranging applications in energy conversion and electronic devices. However, harnessing their superior properties presents a significant challenge due to the delicate balance required between their various states. Here, in this study, through the unique design of nanopillar structures to alleviate the local polar heterogeneity, we have achieved significantly improved piezo-/ferro-electricity in classic lead-free antiferroelectric Ag x NbO 3-δ (x = 1, 0.9, and 0.8) epitaxial thin films. The effective piezoelectric coefficient reaches 440 pm V –1 , 1 order of magnitude larger than the stoichiometric AgNbO 3 , rivaling classic lead zirconate titanate piezoelectrics. Atomic-scale electron microscopy investigations unravel the underlying mechanisms. The nanopillars, characterized by antisite occupancy of both Ag and Nb atoms and forming out-of-phase boundaries with the matrix, reduce the local crystal symmetry via interphase strain. This leads to the creation of flexible multinanodomain structures that significantly facilitate polarization rotation, thus substantially enhancing the piezoelectric performance. This study demonstrates the feasibility of engineering local heterogeneity through nanopillar design, offering a generally applicable method for property improvement of a wide range of antiferroelectrics.

75 CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND↗
DOE OSTI2024

Significantly Promoting the Thermal Conductivity and Machinability of Negative Thermal Expansion Alloy via In Situ Precipitation of Copper Networks

Rapid advancements in electronic devices yield an urgent demand for high-performance electronic packaging materials with high thermal conductivity, low thermal expansion, and great mechanical properties. However, it is a great challenge for current design philosophies to fulfill all the requirements simultaneously. Here, an effective strategy is proposed for significantly promoting the thermal conductivity and machinability of negative thermal expansion alloy (Zr,Nb)Fe 2 through eutectic precipitation of copper networks. The eutectic dual-phase alloy exhibits an isotropic chips-matched thermal expansion coefficient and a thermal conductivity enhancement exceeding 200% compared with (Zr,Nb)Fe 2 , along with an ultimate compressive strength of 550 MPa. The addition of copper reorganizes the composition of (Zr,Nb)Fe 2 , which smooths the magnetic transition and shifts it toward higher temperature, resulting in linear low thermal expansion in a wide temperature range. The highly fine eutectic copper lamellae construct high thermal conductivity networks within (Zr,Nb)Fe 2 , serving as highways for heat transfer electrons and phonons. The in situ forming of eutectic copper lamellae also facilitates the mechanical properties by enhancing interfacial bonding and bearing additional stress after yielding of (Zr,Nb)Fe 2 . This work provides a novel strategy for promoting thermal conductivity and mechanical properties of negative thermal expansion alloys via eutectic precipitation of copper networks.

36 MATERIALS SCIENCE↗
DOE OSTI2024

United States Nuclear Data Program Work Plan for FY 24

The work plan described in this document has been developed to cover work to be performed by the U. S. Nuclear Data Program (USNDP) during Fiscal Year (FY) 2024 that begins on October 1, 2022. Previously, 23 work plans have been prepared for the nuclear data program covering FYs 2021-2022. This plan has been prepared in consultation with the members of the Coordinating Committee who represent the organizations participating in the program. Each Coordinating Committee member prepared a draft plan for his/her organization. Each contribution was integrated into a unified work plan. The draft plan was then circulated to the Coordinating Committee for comments and corrections before the final document was submitted to the U.S. Department of Energy (DOE).

73 NUCLEAR PHYSICS AND RADIATION PHYSICS↗
DOE OSTI2024

United States Nuclear Data Program Annual Report for FY 23

The US Nuclear Data Program (USNDP) Annual Report for Fiscal Year 2023 (FY23) summarizes the work of USNDP for the period of October 1, 2022 through September 30, 2023, with respect to the Work Plan for FY23 that was prepared in 2022. The Work Plan and Final Report for USNDP are prepared for the DOE Office of Science, Office of Nuclear Physics. The support for the nuclear data activity from sources outside the nuclear data program is described in the staffing table and in Appendix A. This leverage amounts to about 17.4 FTE scientific, to be compared with 23.8 FTEs at USNDP units funded by the DOE Office of Science, Office of Nuclear Physics. Since it is often difficult to separate accomplishments funded by various sources, some of the work reported in the present report was accomplished with nuclear data program support leveraged by other funding.

73 NUCLEAR PHYSICS AND RADIATION PHYSICS↗
DOE OSTI2024

Cycloturbine modular river current energy converter and method and apparatus for deploying marine hydrokinetic turbine assembly to harvest riverine and ocean tidal current energy

A hydrokinetic turbine system for harvesting energy from riverine and tidal sources, including a first floating dock, a marine hydrokinetic turbine mounted on the first floating dock, and a second floating dock. The system further includes a winch assembly mounted on the second floating dock and operationally connected to the first floating dock and a linkage assembly operationally connected to the first floating dock and to the second floating dock. The linkage assembly may be actuated to pull the first floating dock into contact with the second floating dock. The linkage assembly may be actuated to distance the first floating dock from the second floating dock, and the winch assembly may be energized to orient the first floating dock into a position wherein the marine hydrokinetic turbine is above the first floating dock and wherein the winch assembly may be energized to orient the first floating dock into a position wherein the marine hydrokinetic turbine is below the first floating dock.

Chen, Jun↗
DOE OSTI2024

Nuclear Structure and Decay Data for A=76 Isobars

The experimental nuclear spectroscopic data for known nuclides of mass number 76 (Fe, Co, Ni, Cu, Zn, Ga, Ge, As, Se, Br, Kr, Rb, Sr, Y) have been evaluated and presented together with Adopted properties for levels and γ rays. With the exception of structure data for 76 Ga nucleus, significant new data have been incorporated for all the other nuclides of A=76 since the previous 1995 update in ENSDF database and NDS publication 1995Si03. No data are yet available for excited states in 76 Fe, 76 Cu and 76 Y. Decay scheme characteristics for the decay of 76 Co, 76 Ni, and 76 Y are unknown while those for decays of 76 Cu and 76 Sr seem incomplete. For 76 Ni, very little structure data are available, and for 76 Ga and 76 As, only low-spin ( or so) information is available. Furthermore, this work supersedes the data presented in the previous (1995Si03) NDS evaluation of A=76.

73 NUCLEAR PHYSICS AND RADIATION PHYSICS↗
DOE OSTI2024

Nuclear Structure and Decay Data for A=165 Isobars

Experimental nuclear spectroscopic data are compiled and evaluated for 18 known nuclides of mass 165 (Pm, Sm, Eu, Gd, Tb, Dy, Ho, Er, Tm, Yb, Lu, Hf, Ta, W, Re, Os, Ir, Pt). Detailed information is presented for each reaction and decay experiment. Combining all the available data, recommended values are provided for energies, spins and parities, and half-lives of levels, with energies, branching ratios and multipolarities of γ radiations, and characteristics of β and α radiations in radioactive decays. 165 Dy, 165 Ho, 165 Er, 165 Tm, 165 Yb, 165 Lu and 165 Hf are among the most extensively studied nuclides via decay and high-spin gamma-ray spectroscopy measurements, followed by limited data for 165 Tb, 165 Ta, 165 W, 165 Re, and 165 Os. No excited states have yet been identified in 165 Sm, 165 Gd, and 165 Pt, while for 165 Eu and 165 Ir, information is available for only the g.s. and an isomer, but with no γ rays. As a result, this work supersedes earlier evaluation of A=165 nuclides by 2006Ja09.

73 NUCLEAR PHYSICS AND RADIATION PHYSICS↗
DOE OSTI2024

Determination of the spins and parities for the 0$^{+}_{4}$ and 0$^{+}_{5}$ states in 100 Zr

Here, two 0 + states at 1294.5 and 1774.0 keV, together with three 2 + and one 4 + levels, were identified or unambiguously spin-parity assigned for the first time in 100 Zr utilizing γ-ray spectroscopy and γ–γ angular correlation techniques with the Gammasphere spectrometer, following the β – decay of neutron-rich, mass-separated 100,100m Y isotopes. Comparisons with recent Monte Carlo shell-model calculations indicate that these two states are candidates for the bandhead of a sequence in a shape-coexisting spherical minimum predicted to be located around ≈1500 keV. According to the measured relative B(E2) relative transition probabilities, the 0$^+_5$ state exhibits decay properties which more closely align with those predicted for a spherical shape, while the 0$^+_4$ level is suggested to be associated with a weakly deformed shape similar to one related to the 0$^+_2$ state.

73 NUCLEAR PHYSICS AND RADIATION PHYSICS↗
DOE OSTI2024

Chemical Framework to Design Linear-like Relaxors toward Capacitive Energy Storage

ABO 3 -type perovskite relaxor ferroelectrics (RFEs) have emerged as the preferred option for dielectric capacitive energy storage. However, the compositional design of RFEs with high energy density and efficiency poses significant challenges owing to the vast compositional space and the absence of general rules. Here, we present an atomic-level chemical framework that captures inherent characteristics in terms of radius and ferroelectric activity of ions. By categorizing A/B-site ions as host framework, rattling, ferroelectrically active, and blocking ions and assembling these four types of ions with specific criteria, linear-like relaxors with weak locally correlated and highly extendable unit-cell polarization vectors can be constructed. As example, we demonstrate two new compositions of Bi 0.5 K 0.5 TiO 3- based and BaTiO 3- based relaxors, showing extremely high recoverable energy densities of 17.3 and 12.1 J cm –3 , respectively, both with a high efficiency of about 90%. Further, the role of different types of ions in forming heterogeneous polar structures is identified through element-specific local structure analysis using neutron total scattering combined with reverse Monte Carlo modeling. Further, our work not only opens up new avenues toward rational compositional design of high energy storage performance lead-free RFEs but also sheds light on atomic-level manipulation of functional properties in compositionally complex ferroelectrics.

25 ENERGY STORAGE↗
DOE OSTI2023

Polysulfide regulation by defect-modulated Ta 3 N 5- x electrocatalyst toward superior room-temperature sodium-sulfur batteries

Resolving low sulfur reaction activity and severe polysulfide dissolution remains challenging in metal-sulfur batteries. Motivated by a theoretical prediction, herein, we strategically propose nitrogen-vacancy tantalum nitride (Ta 3 N 5-x ) impregnated inside the interconnected nanopores of nitrogen-decorated carbon matrix as a new electrocatalyst for regulating sulfur redox reactions in room-temperature sodium-sulfur batteries. Through a pore-constriction mechanism, the nitrogen vacancies are controllably constructed during the nucleation of Ta 3 N 5-x . Further, the defect manipulation on the local environment enables well-regulated Ta 5d-orbital energy level, not only modulating band structure toward enhanced intrinsic conductivity of Ta-based materials, but also promoting polysulfide stabilization and achieving bifunctional catalytic capability toward completely reversible polysulfide conversion. Moreover, the interconnected continuous Ta 3 N 5-x -in-pore structure facilitates electron and sodium-ion transport and accommodates volume expansion of sulfur species while suppressing their shuttle behavior. Due to these attributes, the as-developed Ta 3 N 5-x -based electrode achieves superior rate capability of 730 mAh g -1 at 3.35 A g -1 , long-term cycling stability over 2000 cycles, and high areal capacity over 6 mAh cm -2 under high sulfur loading of 6.2mgcm -2 . This work not only presents a new sulfur electrocatalyst candidate for metal-sulfur batteries, but also sheds light on the controllable material design of defect structure in hopes of inspiring new ideas and directions for future research.

25 ENERGY STORAGE↗
DOE OSTI2023

Nuclear Structure and Decay Data for A=167 Isobars

Experimental nuclear spectroscopic data are compiled and evaluated for 17 known nuclides of mass 167 (Sm, Eu, Gd, Tb, Dy, Ho, Er Tm, Yb, Lu, Hf, Ta, W, Re, Os, Ir, Pt), 23 years after the previous full evaluation by 2000Ba65. Detailed information is presented for each reaction and decay experiment. Combining all the available data, recommended values are provided for energies, spins and parities, and half-lives of levels, with energies, branching ratios and multipolarities of γ radiations, and characteristics of β and α radiations in radioactive decays. Here, the α decays of A=171 nuclei to A=167 daughters are included in this work, while for α decays of A=167 nuclei to A=163 daughters, consult Nuclear Data Sheets (2010Re03) or the ENSDF database for A=163. 167 Er, 167 Tm, 167 Yb, 167 Lu and 167 Ta are among the most extensively studied nuclides via decay and high-spin gamma-ray spectroscopy measurements, followed by 167 Ho, 167 Hf, 167 W, and 167 Os. Information for excited states in 167 Dy, 167 Re, and 167 Ir are limited; no excited states have yet been identified in 167 Sm, 167 Eu, 167 Gd, 167 Tb and 167 Pt, with the ground-state half-life of 167 Sm remaining unknown. This work supersedes the earlier evaluation of A=167 nuclei by 2000Ba65.

73 NUCLEAR PHYSICS AND RADIATION PHYSICS↗
DOE OSTI2023

Local Chemical Clustering Enabled Ultrahigh Capacitive Energy Storage in Pb-Free Relaxors

Designing Pb-free relaxors with both a high capacitive energy density (W rec ) and high storage efficiency (η) remains a remarkable challenge for cutting-edge pulsed power technologies. Local compositional heterogeneity is crucial for achieving complex polar structure in solid solution relaxors, but its role in optimizing energy storage properties is often overlooked. Here, in this paper, we report that an exceptionally high W rec of 15.2 J cm –3 along with an ultrahigh η of 91% can be achieved through designing local chemical clustering in Bi 0.5 Na 0.5 TiO 3 –BaTiO 3 -based relaxors. A three-dimensional atomistic model derived from neutron/X-ray total scattering combined with reverse Monte Carlo method reveals the presence of subnanometer scale clustering of Bi, Na, and Ba, which host differentiated polar displacements, and confirming the prediction by density functional theory calculations. This leads to a polar state with small polar clusters and strong length and direction fluctuations in unit-cell polar vectors, thus manifesting improved high-field polarizability, steadily reduced hysteresis, and high breakdown strength macroscopically. The favorable polar structure features also result in a unique field-increased η, excellent stability, and superior discharge capacity. Our work demonstrates that the hidden local chemical order exerts a significant impact on the polarization characteristic of relaxors, and can be exploited for accessing superior energy storage performance.

25 ENERGY STORAGE↗
DOE OSTI2023

Whole-Voltage-Range Solid-Solution Reaction in Layered Oxide Cathode of Sodium-Ion Batteries

Layered manganese-based oxides (LMOs) are promising cathode materials for sodium-ion batteries (SIBs) due to their versatile structures. However, the Jahn–Teller effect of Mn 3+ induces severe distortion of MnO 6 octahedra, and the resultant low symmetry is responsible for the gliding of MnO 2 layers and then inferior multiple-phase transitions upon Na + extraction/insertion. Here, hexagonal P2-Na 0.643 Li 0.078 Mn 0.827 Ti 0.095 O 2 is synthesized through the incorporation of Li and Ti into the distorted orthorhombic P'2-Na 0.67 MnO 2 to function as a phase-transition-free oxide cathode. Further, it is revealed that Li in both the transition-metal and Na layers enhances the covalency of Mn–O bonds and allows degeneracy of Mn 3d e g orbitals to favor the formation of hexagonal phase, and the high strength of Ti–O bonds reduces the electrostatic interaction between Na and O for suppressed Na + /vacancy rearrangements. These collectively lead to a whole-voltage-range solid-solution reaction between 1.8 and 4.3 V with a small volume variation of 1.49%. This rewards its excellent cycling stability (capacity retention of 90% after 500 cycles) and rate capability (89 mAh g -1 at 2000 mA g -1 ).

25 ENERGY STORAGE↗