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DOE OSTI2026

Terrestrial laser scanning data (Levels 0 and 1) for Pasoh, Malaysia, Sep 2024

This data package contains data from terrestrial laser scanning (TLS) at the Pasoh Forest Reserve, Malaysia. The Pasoh Forest Reserve is a facility of the Forest Research Institute Malaysia, and contains evergreen lowland dipterocarp forest. The Next-Generation Ecosystem Experiments Tropics (NGEE-Tropics) study areas at Pasoh were established to study how different species respond to climatic variation and soil water availability. Two study areas were chosen representing different topography and species. The TLS data archived here were collected to provide detailed, three-dimensional information about forest structure. Specifically, data were collected to allow tree-level characterization of woody structure and leaf area for 12 focal trees with FloraPulse and sap flux sensors, facilitating estimation of woody biomass and leaf area to allow upscaling of water content and transpiration data to the tree-level. Scan positions were not selected to provide consistent data for non-focal trees with the study areas. This data package contains the following data: - High-level files document further details of the campaign and data package: 1_CampaignSummary.csv provides details about the campaign and study site, 2_ScanAreasDetail.csv provides details about each separate scan area (groups of scans post-processed into a single point cloud), 3_TerrestrialLidarSensor.csv provides further technical details about the Riegl VZ-400i TLS sensor, TLS_CSV_dd.csv is a CSV Data Dictionary providing information about the fields in CSV files following the ESS-DIVE CSV File Formatting Guidelines Reporting Format, TLS_flmd.csv is a File Level Metadata file providing information about each file in the data package following the ESS-DIVE File Level Metadata Reporting Format, and README.txt is a text file describing the overall project and file structure. - Level 0 data are the raw data (.PROJ folders) as recorded by the Riegl VZ-400i TLS instrument before scan co-registration and post-processing with the Riegl's proprietary RiSCAN PRO software, which requires a license. - Level 1 data contain post-processed, co-registered data from each scan area. The "PointClouds" folder for each scan area contains a .las file with 1 cm resolution point cloud data exported from RiSCAN PRO. These are the main files likely to be of interest to most users and can be further processed with any software capable of manipulating .las files (e.g. Python, R CloudCompare). The "Project Information" folder contains log files from post-processing in RiSCAN PRO that may be of interest to users who want to see detailed records of post-processing, including all PDF reports generated by RiSCAN PRO. The "ScanPositions" folder contains information about the final position of all TLS scans, after post-processing, in multiple formats. The file ScanPositions_*.csv provides final geo-referenced scan positions, and the file SOP_backup_*.csv can be used in RiSCAN PRO to restore the co-registered scan positions if users wish to re-process raw data (Level 0 .PROJ folders) with RiSCAN PRO software (e.g., subsample to a different resolution, exclude a certain scan position, or apply different filters on reflectance or deviation values) without redoing time-consuming co-registration steps.

54 ENVIRONMENTAL SCIENCES↗
DOE OSTI2023

Pathways to Carbon Neutrality 2050 in Malaysia and Kuala Lumpur

Malaysia has recently set an ambitious target of achieving carbon neutrality as early as 2050. To accomplish this, the country will need to strategically reduce its emissions across all sectors. In 2020, Malaysia emitted approximately 368 MtCO2e, with the largest sources of emissions including electricity (36% of total emissions), transportation (17%), and industry (15%)1. We find that the greatest reductions in emissions can therefore come from decarbonizing power generation and electrifying end-use sectors. Digitalization, smart technologies, and improved energy efficiency will significantly reduce economy-wide energy consumption. By leveraging efficient technologies, both Malaysia and Kuala Lumpur can address the challenges posed by rapid urbanization and climate change. Digitalization is a broad category that includes a variety of measures; for example, the wide adoption of high-efficiency appliances and lighting or improved building energy codes in the buildings sector. Similarly, technological improvements can advance industrial energy efficiency, and for transportation, smart technologies cover a shift from private to public transportation and the greater use of electric vehicles. While renewable energy (RE) will play a crucial role in decarbonization, achieving carbon neutrality in certain sectors will be difficult without emerging technologies like carbon capture and storage (CCS) and innovative fuel sources such as hydrogen. In order for Malaysia to rely on CCS as a mitigation option, early investment and incentives to the private sector will be critical. This holds for the use of hydrogen as well: investing in the necessary technology, infrastructure, and human capital will allow Malaysia to position itself as an innovator in the region and leverage these advanced technologies as a key part of its climate strategy. Another possible carbon removal option other than CCS would be a land-use sink; however, given that Malaysia is still developing and may deforest in the near-term, this report does not focus on the mitigation potential of land-use change. With its innovative and bold climate plans, Kuala Lumpur is primed to be a leader in regional climate change efforts. Kuala Lumpur is also engaged in several international collaborations to ensure sustainable city development such as the C40 network and the ASEAN Smart Cities Partnership. As such, the city will play a critical role in contributing to Malaysia’s overall climate goals and as a policy trendsetter through ambitious, scalable plans. One key factor in these emissions reductions is that Kuala Lumpur has full control over its building guidelines, allowing for ambitious policies resulting in significant emissions reductions. However, in other sectors, Kuala Lumpur has less direct control over regulations; for example, power generation and integration of RE are largely in the hands of the Malaysian government. With limited and primarily light industry, Kuala Lumpur’s contributions to emissions reductions here are curbed. And, while Kuala Lumpur has control over local transportation policies like increasing access to and quality of public transportation, broad shifts in transportation will stem from national-level policies. As such, multi-level governance is an integral component of Malaysia’s climate strategy and coordination between local and national governments will be essential in reducing emissions and achieving other climate goals. This report addresses these and other key challenges and opportunities Malaysia faces on the road to carbon neutrality.

29 ENERGY PLANNING, POLICY, AND ECONOMY↗
DOE OSTI2024

Carbon neutrality in Malaysia and Kuala Lumpur: Insights from stakeholder-driven integrated assessment modeling

Several cities in Malaysia have established plans to reduce their CO2 emissions, in addition to Malaysia submitting a Nationally Determined Contribution to reduce its carbon intensity (against GDP) by 45% in 2030 compared to 2005. Meeting these emissions reduction goals will require a joint effort between governments, industries, and corporations at different scales and across sectors. In collaboration with national and sub-national stakeholders, we developed and used a global integrated assessment model to explore emissions mitigation pathways in Malaysia and Kuala Lumpur. Guided by current climate action plans, we created a suite of scenarios to reflect uncertainties in policy ambition, level of adoption, and implementation for reaching carbon neutrality. Through iterative engagement with all parties, we refined the scenarios and focus of the analysis to best meet the stakeholders’ needs. We found that Malaysia can reduce its carbon intensity and reach carbon neutrality by 2050, and that action in Kuala Lumpur can play a significant role. Decarbonization of the power sector paired with extensive electrification, energy efficiency improvements in buildings, transportation, and industry, and the use of advanced technologies such as hydrogen and carbon capture and storage will be major drivers to mitigate emissions, with carbon dioxide removal strategies being key to eliminate residual emissions. This study highlights the participatory process in which stakeholders contributed to the development of the model and guided the analysis, as well as insights into Malaysia’s decarbonization potential and the role of multilevel governance.

cities↗
DOE OSTI2023

Integrated Urban Services (IUS) Pilot Project Profile - Integrated AgriTech Hub Development in Flagship F Zone: Iskandar Malaysia

This brief provides a project snapshot of the Integrated Urban Services program's support to Iskandar Malaysia for development of an integrated urban agricultural hub. Integrated Urban Services is a U.S. State Department program launched in 2021 under the United States-Association of Southeast Asian Nations Smart Cities Partnership helping cities build resilience in their energy, food, and water provisioning systems.

ASEAN↗
DOE OSTI2022

The concentration of BTEX in selected urban areas of Malaysia during the COVID-19 pandemic lockdown

Volatile organic compounds (VOCs) such as benzene, toluene, ethylbenzene and xylene (BTEX) are air pollutants that harm human health. This study aims to identify BTEX concentrations before the lockdown known as the Movement Control Order was imposed (BMCO), during the implementation of the Movement Control Order (MCO), and then during the Conditional Movement Control Order (CMCO). These orders were introduced during the COVID-19 pandemic in Malaysia. The study utilised data measured by the continuous monitoring of BTEX using online gas chromatography instruments located at three urban area stations. Here, the results showed that the BTEX concentrations reduced by between –38% and –46% during the MCO compared to the BMCO period. The reduction of human mobility during the MCO and CMCO influenced the lower BTEX concentrations recorded at a station within the Kuala Lumpur area. The results of the BTEX diagnostic ratios and principal component analysis showed that the major source of BTEX, especially during the BMCO and CMCO periods, was motor vehicle emissions. Further investigation, using correlation analysis and polar plots, showed that the BTEX concentrations were also influenced by meteorological variables such as wind speed, air temperature and relative humidity.

54 ENVIRONMENTAL SCIENCES↗
DOE OSTI2023

Litterfall and Branchfall Mass Flux in Malaysia Lambir Hills GEM plots (2008-2010)

This data package includes two folders: Litterfall and Branchfall. The Litterfall folder includes three files: "GEM_Lambir_Hills_Litterfall_Mass_Flux_Data_2008_to_2010.csv" includes the litterfall data, the "GEM_Lambir_Hills_Litterfall_Metadata.xlx" includes the descripion of the columns in the data file, and the PDF file "GEM_Lambir_Hills_Litterfall_Methods_Description" includes a brief description of the litterfall sampling methods. The Branchfall Folder includes four files: the "GEM_Lambir_Hills_Branchfall_Data_2009_to_2010.csv" file includes the branchfall data, the "GEM_Lambir_Hills_Branchfall_Metadata_2009_to_2010.xlsx" includes the description of the columns in the csv data file, the "GEM_Lambir_Hills_Branchfall_Methods_Description.pdf" includes a brief description of the branchfall collection methods, and the "GEM_Lambir_Hills_Branchfall_Data_Metadata_Methods_TransectSums.xlx" includes data, metadata, methods description, and a 'TransectsSums' tab where the reader can find the sum of the branchfall data in each transect Litterfall and Branchfall data were collected to quantify canopy productivity and net primary productivity allocated to branch turnover, which are components of the total net primary productivity and ecosystem carbon budget. The methods follow the Global Ecosystems Monitoring (GEM) protocols (see gem.tropicalforests.ox.ac.uk). The data collection took place from 2008 to 2010 in two 1-ha GEM plots in Lambir Hills National Park, Sarawak, Malaysia, within the Lambir 52-ha ForestGEO plots. One of the plots was located on clay soil and the other on sandy loam. The site is an old-growth moist tropical forest dominated by Dipterocarpacea. The climate is moist tropical and aseasonal. Litterfall was collected biweekly from 25 litter traps per plot. Branchfall was estimated using four 100-m transects, which were surveyed every two months.

54 ENVIRONMENTAL SCIENCES↗
DOE OSTI2025

Enhancing the Energy Efficiency of Room Air Conditioners in Malaysia: Opportunities and Impact Analysis

The global room air conditioner (AC) market is rapidly transitioning toward variable-speed units, offering significant opportunities for energy-efficient designs and the adoption of low-global warming potential (GWP) refrigerants. Emerging economies, particularly in regions such as Malaysia, are expected to drive consumer demand for ACs. This report reviews key trends in the Malaysian AC market, including the availability of high-efficient ACs. Currently, variable-speed units account for 30–65% of the market, achieving cooling seasonal performance factor (CSPF) levels of between 5.0 and 6.0. Cost comparisons show that CSPF 5–6-rated, inverter-driven room ACs are competitively priced against lower-efficiency, fixed-speed units.

32 ENERGY CONSERVATION, CONSUMPTION, AND UTILIZATI↗
DOE OSTI2024

Integrated Urban Services: Program Impact and Business Plan Summary

The Integrated Urban Services (IUS) program, launched in 2021 and funded by the U.S. State Department under the United States-Association of Southeast Asian Nations (US-ASEAN) Smart Cities Partnership, aimed to bolster resilience in ASEAN cities by addressing challenges across food, energy, and water systems. Led by the National Renewable Energy Lab (NREL) with support from Regenerative Impact Ventures, the program focused on demonstrating the socio-economic benefits of integrated urban planning, educating stakeholders on circular economy principles, providing technical assistance to two ASEAN cities, and attracting private sector involvement. The program facilitated peer learning events, engaging public and private sector participants and leveraging knowledge from a group of global experts to inform approaches and best practices. Technical assistance was provided to two pilot cities, Iskandar Malaysia and Cagayan de Oro, Philippines, resulting in the development of market-driven business plans for resilient, circular, and regenerative energy-water-food system projects. The Iskandar Malaysia pilot focused on development of a state-of-the-art AgriTech Innovation Hub and Modern Farming Complex to enhance agricultural productivity and produce enough renewable energy to power the facilities. The Cagayan de Oro project aimed to enhance urban agricultural productivity and waste management through development of an Urban Precision Agricultural Complex featuring aeroponics, hydroponics, aquaponics, agrivoltaics, and a Black Solider Fly Facility for converting municipal solid waste into commodities. The success of the IUS program sets a precedent for replicating integrated urban service models globally, offering valuable insights for cities aiming to enhance their resilience and sustainability.

ASEAN↗
DOE OSTI2020

Clean Energy Manufacturing: Renewable Energy Technology Benchmarks

The manufacturing of clean energy technologies has become a global enterprise. An analysis of four clean energy technology manufacturing processes—wind turbine components, crystalline silicon solar photovoltaic modules, light-duty vehicle lithium-ion battery cells, and light-emitting diodes—was conducted to provide a reference point for comparison over time as this sector evolves. The manufacturing supply chain analysis included processing of raw materials, making required subcomponents, and assembling final products, using benchmarks that crossed 12 economies: Brazil, Canada, China, Germany, India, Japan, Malaysia, Mexico, South Korea, Republic of China (Taiwan), the United Kingdom, and the United States. Larger economies, with extensive manufacturing supply chains and high prevailing wages, tend to retain more value added from clean energy manufacturing than small economies. Manufacturing of clean energy technologies drives extensive trade among economies to support the widely distributed supply chain links. Production of wind turbine components and photovoltaic modules is more centralized than production of light-emitting diodes and lithium-ion battery cells. Across the four clean energy technologies evaluated, there was generally an excess of manufacturing capacity relative to global supply.

benchmarks↗
DOE OSTI2021

Using bursty announcements for detecting BGP routing anomalies

Despite the robust structure of the Internet, it is still susceptible to disruptive routing updates that prevent network traffic from reaching its destination. Our research shows that BGP announcements that are associated with disruptive updates tend to occur in groups of relatively high frequency, followed by periods of infrequent activity. We hypothesize that we may use these bursty characteristics to detect anomalous routing incidents. In this work, we use manually verified ground truth metadata and volume of announcements as a baseline measure, and propose a burstiness measure that detects prior anomalous incidents with high recall and better precision than the volume baseline. We quantify the burstiness of inter-arrival times around the date and times of four large-scale incidents: the Indosat hijacking event in April 2014, the Telecom Malaysia leak in June 2015, the Bharti Airtel Ltd. hijack in November 2015, and the MainOne leak in November 2018; and three smaller scale incidents that led to traffic interception: the Belarusian traffic direction in February 2013, the Icelandic traffic direction in July 2013, and the Russian telecom that hijacked financial services in April 2017. Our method leverages the burstiness of disruptive update messages to detect these incidents. We describe limitations, open challenges, and how this method can be used for routing anomaly detection.

97 MATHEMATICS AND COMPUTING↗
DOE OSTI2023

Efficacy of antivirals and mRNA vaccination against an XBF clinical isolate

Recombination events occur frequently in severe acute respiratory syndrome coronavirus 2 (SARS-CoV-2), resulting in genetic diversity. Because these events contribute to altered host immune evasion and antiviral susceptibility, it is crucial to evaluate the efficacy of COVID-19 vaccines and antivirals against recombinant variants. As of March 2023, XBB.1.5, a recombinant sublineage of XBB, is currently the dominant form globally (Fig. S1A, Supplementary Appendix). XBB emerged as a result of recombination between two BA.2 descendants, BJ.1 and BM.1.1.1 (a progeny of BA.2.75). We and other groups have shown that XBB.1.5 is resistant to several therapeutic monoclonal antibodies and effectively evades humoral immunity elicited by natural infection or COVID-19 vaccination.1, 2, 3 By March 30, 2023, an additional recombinant variant, XBF, had been sampled 8966 times in 47 countries and territories in GISAID, reaching it highest prevalence in Australia and New Zealand (Fig. S2, Supplementary Appendix). XBF is still increasing in frequency, although the prevalence of XBB.1.5 appears to be increasing at a faster pace in most regions (Fig. S1B, Supplementary Appendix). XBF is a recombinant of BA.5.2.3 (a descendant of BA.5) and CJ.1 (a descendant of BA.2.75) and, like CJ.1, has an additional three substitutions (R346T, F486P, and F490S) in the receptor-binding domain (RBD) of the consensus form of its spike protein compared to baseline BA.2.75 (Fig. S3A, Supplementary Appendix). CJ.1 and its related sublineage CJ.1.1 did not expand as extensively as XBF, being sampled in GISAID only 1589 and 142 times respectively. CJ.1 was found circulating in many countries, but most commonly sampled in South Korea, where it is still increasing and has currently reached about 5% of the sampled population. CJ.1.1 was most frequently sampled in Malaysia and Singapore, but remained rare in both nations, peaking at about 1% of the sample in December of 2022. Despite the importance of these related variants, we have no information about the antiviral efficacy and immunity induced by COVID-19 vaccines against a clinical isolate of XBF.

60 APPLIED LIFE SCIENCES↗
DOE OSTI2021

Estimating induced land use change emissions for sustainable aviation biofuel pathways

Sustainable aviation fuels (SAFs) are expected to play an essential role in achieving the aviation industries’ goal of carbon-neutral growth. However, producing biomass-based SAFs may induce changes in global land use and the associated carbon stock. The induced land use change (ILUC) emissions, as a part of the full life-cycle emissions for SAF pathways, will affect whether and to what extent SAFs reduce emissions compared with petroleum-based jet fuels. Here, we estimate the ILUC emission intensity for seventeen SAF pathways considered by the International Civil Aviation Organization (ICAO), covering five ASTM-certified technologies, nine biomass-based feedstocks, and four geographical regions. We introduce the SAF pathways into a well-established computable general equilibrium (CGE) model, GTAP-BIO, and its coupled emission accounting model, AEZ-EF, to study economy-wide implications of SAF production and estimate ILUC emissions intensity for each pathway. The estimated SAF ILUC emission intensities, using a 25-year amortization period, range from -58.5 g CO 2 e MJ -1 for the USA miscanthus alcohol (isobutanol)-to-jet (ATJ) pathway to 34.6 g CO 2 e MJ -1 for the Malaysia & Indonesia palm oil Hydrotreated Esters of Fatty Acids (HEFA) pathway. Notably, the vegetable oil pathways tend to have higher ILUC emission intensities due to their linkage to palm expansion and peatland oxidation in Southeast Asia. The cellulosic pathways studied provide negative ILUC emissions, mainly driven by the high carbon sequestrations in crop biomass and soil. Using the core life-cycle emissions established by ICAO, we show that fifteen of the assessed pathways have a lower full life-cycle emission intensity than petroleum-based jet fuels (89 g CO 2 e MJ -1 ), offering promising options to reduce aviation emissions.

09 BIOMASS FUELS↗
DOE OSTI2022

Peatland Loss in Southeast Asia Contributing to U.S. Biofuel’s Greenhouse Gas Emissions

Land use change (LUC) induced by biofuel production could lead to greenhouse gas (GHG) emissions, which potentially increase biofuel’s carbon intensity. Among the sources of LUC-related emissions for soy biodiesel, the contribution from peatland loss to agricultural plantations in Southeast Asia remains uncertain. Here, in this study, we analyzed LUC in Malaysia and Indonesia and modeled its impacts on the GHG emissions of soy biodiesel produced in the United States. It shows that oil palm plantations have more than doubled over 2001–2016 and the area of palm-on-peatlands (PoP) has expanded 3.7 times. Over new palm plantations, the share of PoP is about 19% regardless of time and location and the emission factor (EF) for peatland-to-palm conversion is estimated to be 41.5 Mg CO 2 ha –1 yr –1 . With these updates on PoP and EF, the contribution of peatland loss (0.7–5.1 g CO 2 e MJ –1 ) to biodiesel emissions is only 40–65% of previous estimates, which reduces discrepancies among model simulations used by different agencies. Based on emerging evidence on LUC and related carbon changes, our analysis reexamines regional peatland loss and its impacts on LUC emissions modeling and provides new insights into the estimation of LUC impacts on biofuels’ carbon intensity.

54 ENVIRONMENTAL SCIENCES↗
DOE OSTI2024

Case study on climate change effects and food security in Southeast Asia

Agriculture, a cornerstone of human civilization, faces rising challenges from climate change, resource limitations, and stagnating yields. Precise crop production forecasts are crucial for shaping trade policies, development strategies, and humanitarian initiatives. This study introduces a comprehensive machine learning framework designed to predict crop production. We leverage CMIP5 climate projections under a moderate carbon emission scenario to evaluate the future suitability of agricultural lands and incorporate climatic data, historical agricultural trends, and fertilizer usage to project yield changes. Our integrated approach forecasts significant regional variations in crop production across Southeast Asia by 2028, identifying potential cropland utilization. Specifically, the cropland area in Indonesia, Malaysia, Philippines, and Viet Nam is projected to decline by more than 10% if no action is taken, and there is potential to mitigate that loss. Moreover, rice production is projected to decline by 19% in Viet Nam and 7% in Thailand, while the Philippines may see a 5% increase compared to 2021 levels. Our findings underscore the critical impacts of climate change and human activities on agricultural productivity, offering essential insights for policy-making and fostering international cooperation.

54 ENVIRONMENTAL SCIENCES↗
DOE OSTI2023

Boosting Thailand’s palm oil yield with advanced seasonal predictions

Palm oil, an indispensable global commodity, plays a crucial role in Thailand's economy (Maluin et al 2020). This versatile product, found in everything from food to biodiesel and industrial applications (Kamil and Omar 2017, Chiarawipa et al 2020), cements Thailand's position as the third-largest producer in the world. The industry is particularly vital in the southern regions, where most plantations are located (Dallinger 2011), providing employment opportunities in rural areas and bolstering the nation's GDP and foreign exchange earnings through exports. However, oil palm productivity hinges on climatic conditions, with precipitation patterns being especially influential. Both local climate and remote forces like El Niño-Southern Oscillation (ENSO) significantly impact production. In neighboring Malaysia, research by Kamil and Omar (2017) has uncovered the consequential role of ENSO events on precipitation and, subsequently, palm oil productivity.

54 ENVIRONMENTAL SCIENCES↗
DOE OSTI2023

Tree damage and mortality measurements across seven ForestGEO plots in the tropics between Oct 2016 and Mar 2023

Annual records (raw data) on tree survival and structural completeness of 36,524 trees (2,467 species) collected across 29 censuses in seven tropical forests distributed across the Neotropics (Amacayacu, Colombia; Barro Colorado Island (BCI), Panamá; Yasuní, Ecuador) and Asia (Fushan, Taiwan; Huai Kha Khaeng (HKK), Thailand; Khao Chong (KC), Thailand; Pasoh, Malaysia). This dataset was used to compare aboveground biomass loss via damage to living trees relative to total AGB loss (mortality + damage). Variable definitions: site: name of the ForestGEO plot stemID.ams: Unique ID for the stem in the annual mortality surveys (ams) treeID.ams: Unique ID for the tree in the ams date.full.census: date of the previous full census of the plot, format: YYYY-MM-DD dbh.full.census: diameter at the breast height (dbh in mm) measured during the previous full census of the plot home: height of measurement of dbh (in m) meanWD: species-level wood density (g cm-3) date.ams: date of the ams, format: YYYY-MM-DD status: survival status of the tree (A: alive; D: dead; NF: not found; "?": unknown) H_considering_damage: living length of the main axis in meters; provides an estimate of the amount of remaining living tissues along the main axis of the stem (e.g., the height of breakage or the height discounting wood decay) b: the remaining proportion of branch volume within the living length (b∈[0,1]). weights.ind: frequency of the [size class x species] bins within the forest plot relative to their frequency in the sample. Necessary to extrapolate estimates to the whole plot.

54 ENVIRONMENTAL SCIENCES↗
DOE OSTI2025

Orbital selective band re-normalization induced Lifshitz transition in TiSe 2

A Lifshitz transition is a sudden change in Fermi surface topology, often linked to quantum phenomena, with major impact on transport and sometimes superconductivity. Here we demonstrate a Lifshitz transition in TiSe 2 using micro–angle-resolved photoemission spectroscopy. At low temperatures an electron pocket appears at the Brillouin-zone center, whereas at higher temperatures spectral weight from a hole-like valence band dominates the Fermi level. Unlike previously reported cases typically driven by rigid band shifts, in TiSe 2 an orbital-selective strong band renormalization induces the crossover near 160 K. This mechanism naturally explains the longstanding resistivity anomaly of TiSe 2 , which peaks around 160 K. Our results clarify its puzzling transport behavior and open avenues to investigate how periodic lattice distortions interact with strong electronic correlations.

36 MATERIALS SCIENCE↗
DOE OSTI2025

Correlation-driven topological band inversion in VSe 2

Recent spectroscopic studies have uncovered topological surface states and band inversion in 1⁢T−VSe 2 , positioning this material at the intersection of correlated electron physics and nontrivial band topology. While previous interpretations attribute these features to surface strain, the microscopic origin of the topological band structure remains unresolved. Here, we present an alternative explanation based on electronic correlations, showing that a negative effective Hubbard interaction (𝑈 eff < 0) applied to the Se 4p orbitals can reproduce the experimentally observed band inversion at both the Γ and 𝑀 points. Using density functional theory (DFT) calculations with orbital-selective interactions, we demonstrate that this approach naturally gives rise to topological surface states without invoking structural distortions. In conclusion, our results highlight the crucial role of ligand orbital correlations in shaping band topology and provide a novel framework for understanding and engineering topological phases in chalcogenide-based quantum materials.

36 MATERIALS SCIENCE↗