{"status":"ok","message-type":"work","message-version":"1.0.0","message":{"indexed":{"date-parts":[[2026,10,23]],"date-time":"2026-10-23T19:47:35Z","timestamp":1792784855224,"version":"4.5.0"},"reference-count":66,"publisher":"American Chemical Society (ACS)","issue":"38","license":[{"start":{"date-parts":[[2026,9,1]],"date-time":"2026-09-01T00:00:00Z","timestamp":1788220800000},"content-version":"vor","delay-in-days":0,"URL":"https:\/\/creativecommons.org\/licenses\/by\/4.0\/"}],"funder":[{"DOI":"10.13039\/501100005285","name":"Funda??o de Amparo ? Pesquisa do Estado de Goi?s","doi-asserted-by":"publisher","award":["202510267001608"],"award-info":[{"award-number":["202510267001608"]}],"id":[{"id":"10.13039\/501100005285","id-type":"DOI","asserted-by":"publisher"}]},{"DOI":"10.13039\/501100003593","name":"Conselho Nacional de Desenvolvimento Cient?fico e Tecnol?gico","doi-asserted-by":"publisher","id":[{"id":"10.13039\/501100003593","id-type":"DOI","asserted-by":"publisher"}]},{"DOI":"10.13039\/501100002322","name":"Coordena??o de Aperfei?oamento de Pessoal de N?vel Superior","doi-asserted-by":"publisher","id":[{"id":"10.13039\/501100002322","id-type":"DOI","asserted-by":"publisher"}]},{"name":"Instituto Nacional de Ci?ncia e Tecnologia de Nanocarbono e Materiais 2D","award":["408649\/2024-0"],"award-info":[{"award-number":["408649\/2024-0"]}],"id":[{"id":"https:\/\/ror.org\/01fb1ke49","id-type":"ROR","asserted-by":"crossref"}]}],"content-domain":{"domain":[],"crossmark-restriction":false},"short-container-title":[],"published-print":{"date-parts":[[2026,9,29]]},"abstract":"<jats:title>Abstract<\/jats:title>\n                  <jats:p>By combining hybrid ab initio electronic-structure calculations that include spin\u2013orbit coupling with phonon-spectrum calculations and molecular-dynamics simulations, we systematically investigate a family of hexagonal XY and fluorinated XYF2 monolayers (X, Y = C, Si, Ge, Sn; X \u2260 Y). All compounds are confirmed to be dynamically and thermally stable, with fluorination being exothermic and further enhancing lattice robustness. Fluorination universally drives a transition from planar sp2 to buckled sp3 structures, which strongly affects the electronic structure. For instance, CSi, CGe, and CSn already display sizable gaps (3.28, 2.85, and 1.96 eV, respectively) that shift slightly upon fluorination to 3.21, 2.97, and 2.27 eV. In contrast, narrow-gap systems such as SiGe (0.19 eV) and SiSn (0.41 eV) exhibit pronounced bandgap openings to 1.43 and 1.02 eV, respectively, corresponding to relative increases of \u223c653 and \u223c149%. GeSn, however, remains a narrow-gap semiconductor (0.33 \u2192 0.28 eV), showing little sensitivity to functionalization. We further investigate the corresponding van der Waals bilayers and trilayers and determine their absolute band-edge positions relative to the vacuum level to evaluate their potential for photocatalytic water splitting. For CSi+CSiF2, SiSn+SiSnF2, and GeSn+SiSnF2 heterobilayers, we identify both type-II and type-III alignments. In CSi-based trilayers, fluorination drives a systematic transformation from a graphitic sp2 lattice to a fully diamondized sp3 lattice, driving substantial hybridization changes and a pronounced reshaping of the band structure.<\/jats:p>","DOI":"10.1021\/acsomega.6c04011","type":"journal-article","created":{"date-parts":[[2026,9,3]],"date-time":"2026-09-03T10:50:11Z","timestamp":1788432611000},"page":"57004-57015","source":"Crossref","is-referenced-by-count":0,"title":["Fluorination Effects\nin Hexagonal XY (X, Y = C, Ge,\nSi, Sn; X \u2260 Y) Monolayers and vdW Heterostructures: Insights\nfrom\n                    <i>Ab Initio<\/i>\n                    Calculations"],"prefix":"10.1021","volume":"11","author":[{"ORCID":"https:\/\/orcid.org\/0000-0002-3336-3882","authenticated-orcid":true,"given":"Renato B.","family":"Pontes","sequence":"first","affiliation":[{"name":"Universidade Federal de Goia\u0301s , , Campus Samambaia , , ,","place":["Goia\u0302nia, Goia\u0301s, Brazil, 74690-900"]}],"role":[{"vocabulary":"crossref","role":"author"}]},{"ORCID":"https:\/\/orcid.org\/0000-0002-1407-7602","authenticated-orcid":true,"given":"Danilo P.","family":"Kuritza","sequence":"additional","affiliation":[{"name":"Universidade Estadual de Maringa\u0301 , , , ,","place":["Maringa\u0301, Parana\u0301, Brazil, 87020-900"]},{"name":"Universidade Federal do Parana\u0301 , , , ,","place":["Jandaia do Sul, Parana\u0301, Brazil, 86900-000"]}],"role":[{"vocabulary":"crossref","role":"author"}]},{"ORCID":"https:\/\/orcid.org\/0000-0003-2398-4543","authenticated-orcid":true,"given":"Rafael","family":"Barbosa","sequence":"additional","affiliation":[{"name":"Universidade Estadual de Maringa\u0301 , , , ,","place":["Maringa\u0301, Parana\u0301, Brazil, 87020-900"]}],"role":[{"vocabulary":"crossref","role":"author"}]},{"ORCID":"https:\/\/orcid.org\/0000-0002-4299-2808","authenticated-orcid":true,"given":"Jose\u0301 E.","family":"Padilha","sequence":"additional","affiliation":[{"name":"Universidade Estadual de Maringa\u0301 , , , ,","place":["Maringa\u0301, Parana\u0301, Brazil, 87020-900"]},{"name":"Universidade Federal do Parana\u0301 , , , ,","place":["Jandaia do Sul, Parana\u0301, Brazil, 86900-000"]}],"role":[{"vocabulary":"crossref","role":"author"}]}],"member":"316","published-online":{"date-parts":[[2026,9,1]]},"reference":[{"key":"2026092911113274100_cit1","doi-asserted-by":"publisher","first-page":"1","DOI":"10.1021\/nl0001914","article-title":"Perspective:\nNanoscience","volume":"1","author":"Alivisatos","year":"2001","journal-title":"Nano Lett"},{"key":"2026092911113274100_cit2","first-page":"3929","article-title":"Emerging Opportunities\nin Nanoscience: From Fundamental Principles to Functional Applications","volume":"15","author":"Gao","year":"2021","journal-title":"ACS Nano"},{"key":"2026092911113274100_cit3","doi-asserted-by":"publisher","first-page":"666","DOI":"10.1126\/science.1102896","article-title":"Electric field effect\nin atomically thin carbon films","volume":"306","author":"Novoselov","year":"2004","journal-title":"Science"},{"key":"2026092911113274100_cit4","first-page":"404","article-title":"Tuning\nsuperconductivity in twisted bilayer graphene","volume":"658","author":"Yankowitz","year":"2021","journal-title":"Nature"},{"key":"2026092911113274100_cit5","first-page":"82","article-title":"Universal dynamics of living topological defects in\nhoneycomb graphene","volume":"587","author":"Zhu","year":"2020","journal-title":"Nature"},{"issue":"6191","key":"2026092911113274100_cit6","doi-asserted-by":"publisher","first-page":"1489","DOI":"10.1126\/science.1250140","article-title":"The valley\nHall\neffect in MoS2 transistors","volume":"344","author":"Mak","year":"2014","journal-title":"Science"},{"key":"2026092911113274100_cit7","first-page":"1389","article-title":"Controlled growth of large-area MoS2\natomic layers by chemical vapor deposition","volume":"371","author":"Xie","year":"2021","journal-title":"Science"},{"key":"2026092911113274100_cit8","first-page":"377","article-title":"Polarized\ncoherent\nphonon generation in hexagonal boron nitride","volume":"594","author":"Corso","year":"2021","journal-title":"Nature"},{"key":"2026092911113274100_cit9","doi-asserted-by":"publisher","first-page":"722","DOI":"10.1038\/nnano.2010.172","article-title":"Boron nitride substrates for high-quality\ngraphene electronics","volume":"5","author":"Dean","year":"2010","journal-title":"Science"},{"key":"2026092911113274100_cit10","doi-asserted-by":"publisher","first-page":"4033","DOI":"10.1021\/nn501226z","article-title":"Phosphorene: An unexplored 2D semiconductor\nwith a high hole mobility","volume":"8","author":"Liu","year":"2014","journal-title":"Nano Lett"},{"key":"2026092911113274100_cit11","doi-asserted-by":"publisher","first-page":"4248","DOI":"10.1002\/adma.201102306","article-title":"Two-dimensional\nnanocrystals produced by exfoliation of Ti3AlC2","volume":"23","author":"Naguib","year":"2011","journal-title":"Adv. Mater"},{"key":"2026092911113274100_cit12","first-page":"1","article-title":"Two-dimensional early transition\nmetal carbides","volume":"2","author":"Liu","year":"2017","journal-title":"Nat. Rev. Mater"},{"key":"2026092911113274100_cit13","doi-asserted-by":"publisher","first-page":"1692","DOI":"10.1126\/science.1136573","article-title":"Z 2 topological\norder and the quantum spin Hall effect","volume":"314","author":"Kane","year":"2006","journal-title":"Science"},{"key":"2026092911113274100_cit14","first-page":"026805","article-title":"Observation\nof the quantum spin Hall effect\nin monolayer 1T\u2019-WTe2","volume":"127","author":"Tang","year":"2021","journal-title":"Phys. Rev. Lett"},{"key":"2026092911113274100_cit15","doi-asserted-by":"publisher","first-page":"699","DOI":"10.1038\/nnano.2012.193","article-title":"Electronics\nand optoelectronics of two-dimensional transition metal dichalcogenides","volume":"7","author":"Wang","year":"2012","journal-title":"Nat. Nanotechnol"},{"key":"2026092911113274100_cit16","doi-asserted-by":"publisher","first-page":"419","DOI":"10.1038\/nature12385","article-title":"Van der Waals heterostructures","volume":"499","author":"Geim","year":"2013","journal-title":"Nature"},{"key":"2026092911113274100_cit17","doi-asserted-by":"publisher","first-page":"263","DOI":"10.1038\/nchem.1589","article-title":"The chemistry of two-dimensional layered transition metal dichalcogenide\nnanosheets","volume":"5","author":"Chhowalla","year":"2013","journal-title":"Nature Chem"},{"issue":"6298","key":"2026092911113274100_cit18","doi-asserted-by":"publisher","first-page":"aac9439","DOI":"10.1126\/science.aac9439","article-title":"2D materials\nand van der Waals heterostructures","volume":"353","author":"Novoselov","year":"2016","journal-title":"Science"},{"key":"2026092911113274100_cit19","doi-asserted-by":"publisher","first-page":"2898","DOI":"10.1021\/nn400280c","article-title":"Progress, challenges,\nand opportunities in\ntwo-dimensional materials beyond graphene","volume":"7","author":"Butler","year":"2013","journal-title":"ACS\nNano"},{"key":"2026092911113274100_cit20","first-page":"5191","article-title":"Silicene, germanene,\nand stanene: recent advances in two-dimensional materials beyond graphene","volume":"5","author":"Li","year":"2013","journal-title":"Nanoscale"},{"issue":"15","key":"2026092911113274100_cit21","doi-asserted-by":"publisher","first-page":"155501","DOI":"10.1103\/PhysRevLett.108.155501","article-title":"Silicene:\ncompelling experimental evidence for graphenelike two-dimensional\nsilicon","volume":"108","author":"Vogt","year":"2012","journal-title":"Phys. Rev. Lett"},{"issue":"24","key":"2026092911113274100_cit22","doi-asserted-by":"publisher","first-page":"245501","DOI":"10.1103\/PhysRevLett.108.245501","article-title":"Experimental\nevidence for epitaxial silicene on diboride\nthin films","volume":"108","author":"Fleurence","year":"2012","journal-title":"Phys. Rev. Lett"},{"key":"2026092911113274100_cit23","first-page":"5033","article-title":"Bottom-up synthesis\nof germanane:\na buckled germanium layer with graphene-like structure","volume":"11","author":"Liu","year":"2011","journal-title":"Nano Lett"},{"key":"2026092911113274100_cit24","first-page":"1105","article-title":"Experimental realization\nof two-dimensional stanene","volume":"12","author":"Deng","year":"2017","journal-title":"Nat. Nanotechnol"},{"key":"2026092911113274100_cit25","first-page":"9065","article-title":"Plumbanene: A Layered\nMaterial with Honeycomb Layers of Pb Atoms","volume":"57","author":"Wang","year":"2018","journal-title":"Angew. Chem., Int. Ed"},{"key":"2026092911113274100_cit26","first-page":"1804745","article-title":"Two-Dimensional SiGe Alloys: A Review\nof Growth Techniques, Properties, and Applications","volume":"31","author":"Vastola","year":"2019","journal-title":"Adv. Mater"},{"key":"2026092911113274100_cit27","first-page":"6379","article-title":"Atomically\nthin two-dimensional SiSn alloys","volume":"13","author":"He","year":"2019","journal-title":"ACS Nano"},{"key":"2026092911113274100_cit28","first-page":"2019","article-title":"Surface fluorination of Ge nanowires:\nenhancing the electrochemical performance for lithium-ion batteries","volume":"49","author":"Li","year":"2013","journal-title":"Chem. Commun"},{"key":"2026092911113274100_cit29","first-page":"1719","article-title":"Fluorinated tin oxide electrodes for efficient perovskite\nsolar cells","volume":"26","author":"Li","year":"2016","journal-title":"Adv. Funct. Mater"},{"key":"2026092911113274100_cit30","first-page":"8907","article-title":"Enhanced performance of tin oxide-based\nperovskite solar cells via surface fluorination of SnO2","volume":"7","author":"Li","year":"2019","journal-title":"J. Mater. Chem. C"},{"key":"2026092911113274100_cit31","first-page":"095104","article-title":"Stability, diffusion, and diffusion\nmechanism of fluorine adatoms on graphene","volume":"121","author":"Luo","year":"2017","journal-title":"J.\nAppl. Phys"},{"key":"2026092911113274100_cit32","first-page":"3945","article-title":"Fluorine in\ntwo-dimensional materials: A comprehensive review","volume":"47","author":"Lin","year":"2018","journal-title":"Chem. Soc. Rev"},{"key":"2026092911113274100_cit33","first-page":"136804","article-title":"Fluorine-functionalized monolayer stanene: A promising\ntwo-dimensional topological insulator","volume":"111","author":"Zhao","year":"2013","journal-title":"Phys.\nRev. Lett"},{"key":"2026092911113274100_cit34","first-page":"245439","article-title":"Tuning\nelectronic structure of graphene\nby fluorination: A density functional theory study","volume":"85","author":"Peng","year":"2012","journal-title":"Phys. Rev. B"},{"issue":"8","key":"2026092911113274100_cit35","doi-asserted-by":"publisher","first-page":"3001","DOI":"10.1021\/nl101437p","article-title":"Properties\nof fluorinated graphene\nfilms","volume":"10","author":"Robinson","year":"2010","journal-title":"Nano Lett"},{"key":"2026092911113274100_cit36","first-page":"1905124","article-title":"Fluorine in two-dimensional materials: From preparation to applications","volume":"32","author":"Chhowalla","year":"2020","journal-title":"Adv. Mater"},{"key":"2026092911113274100_cit37","first-page":"862","article-title":"Fluorination of two-dimensional\nmaterials: Synthesis, properties,\nand applications","volume":"48","author":"Huang","year":"2019","journal-title":"Chem. Soc. Rev"},{"key":"2026092911113274100_cit38","doi-asserted-by":"publisher","first-page":"B864","DOI":"10.1103\/PhysRev.136.B864","article-title":"Inhomogeneous electron\ngas","volume":"136","author":"Hohenberg","year":"1964","journal-title":"Physics Review"},{"key":"2026092911113274100_cit39","doi-asserted-by":"publisher","first-page":"A1133","DOI":"10.1103\/PhysRev.140.A1133","article-title":"Self-consistent\nEquations including exchange and correlation\neffects","volume":"140","author":"Kohn","year":"1965","journal-title":"Physics Review"},{"key":"2026092911113274100_cit40","doi-asserted-by":"publisher","first-page":"11169","DOI":"10.1103\/PhysRevB.54.11169","article-title":"Efficient\nIterative Schemes for Ab initio Total-energy\nCalculations Using a Plane-wave Basis Set","volume":"54","author":"Kresse","year":"1996","journal-title":"Phys.\nRev. B"},{"key":"2026092911113274100_cit41","doi-asserted-by":"publisher","first-page":"15","DOI":"10.1016\/0927-0256(96)00008-0","article-title":"Efficiency of Ab-initio total Energy Calculations for\nMetals and Semiconductors Using a Plane-wave Basis Set","volume":"6","author":"Kresse","year":"1996","journal-title":"Comput. Mater. Sci"},{"key":"2026092911113274100_cit42","doi-asserted-by":"publisher","first-page":"3865","DOI":"10.1103\/PhysRevLett.77.3865","article-title":"Generalized\nGradient Approximation\nMade Simple","volume":"77","author":"Perdew","year":"1996","journal-title":"Phys. Rev. Lett"},{"key":"2026092911113274100_cit43","doi-asserted-by":"publisher","first-page":"8207","DOI":"10.1063\/1.1564060","article-title":"Hybrid Functionals\nBased on a Screened\nCoulomb Potential","volume":"118","author":"Heyd","year":"2003","journal-title":"J. Chem. Phys"},{"issue":"21","key":"2026092911113274100_cit44","doi-asserted-by":"publisher","first-page":"219906","DOI":"10.1063\/1.2204597","article-title":"Erratum: \u201cHybrid\nFunctionals\nBased on a Screened Coulomb potential\u201d [J. Chem. Phys. 118,\n8207 (2003)]","volume":"124","author":"Heyd","year":"2006","journal-title":"J. Chem. Phys"},{"key":"2026092911113274100_cit45","doi-asserted-by":"publisher","first-page":"1758","DOI":"10.1103\/PhysRevB.59.1758","article-title":"From Ultrasoft Pseudopotentials to the Projector Augmented-wave\nMethod","volume":"59","author":"Kresse","year":"1999","journal-title":"Phys. Rev. B"},{"key":"2026092911113274100_cit46","doi-asserted-by":"publisher","first-page":"5188","DOI":"10.1103\/PhysRevB.13.5188","article-title":"Special Points for\nBrillouin-zone Integrations","volume":"13","author":"Monkhorst","year":"1976","journal-title":"Phys. Rev. B"},{"key":"2026092911113274100_cit47","doi-asserted-by":"publisher","first-page":"1787","DOI":"10.1002\/jcc.20495","article-title":"Semiempirical\nGGA-type density functional constructed with a long-range dispersion\ncorrection","volume":"27","author":"Grimme","year":"2006","journal-title":"J. Comput. Chem"},{"key":"2026092911113274100_cit48","doi-asserted-by":"publisher","first-page":"1456","DOI":"10.1002\/jcc.21759","article-title":"Effect of\nthe damping function in\ndispersion corrected density functional theory","volume":"32","author":"Grimme","year":"2011","journal-title":"J. Comput. Chem"},{"key":"2026092911113274100_cit49","doi-asserted-by":"publisher","first-page":"511","DOI":"10.1063\/1.447334","article-title":"A unified\nformulation of the constant temperature molecular dynamics methods","volume":"81","author":"Nose\u0301","year":"1984","journal-title":"J. Chem. Phys"},{"key":"2026092911113274100_cit50","doi-asserted-by":"publisher","first-page":"134106","DOI":"10.1103\/PhysRevB.78.134106","article-title":"First-principles calculations of the ferroelastic transition\nbetween rutile-type and CaCl2-type SiO2 at high\npressures","volume":"78","author":"Togo","year":"2008","journal-title":"Phys. Rev. B"},{"key":"2026092911113274100_cit51","doi-asserted-by":"publisher","first-page":"108033","DOI":"10.1016\/j.cpc.2021.108033","article-title":"VASPKIT: A user-friendly\ninterface facilitating high-throughput computing and analysis using\nVASP code","volume":"267","author":"Wang","year":"2021","journal-title":"Comput. Phys. Commun"},{"issue":"1","key":"2026092911113274100_cit52","doi-asserted-by":"publisher","first-page":"351","DOI":"10.1186\/s11671-015-1040-y","article-title":"Band Gap\nCharacters and Ferromagnetic\/Antiferromagnetic\nCoupling in Group-IV Monolayers Tuned by Chemical Species and Hydrogen\nAdsorption Configurations","volume":"10","author":"Yu","year":"2015","journal-title":"Nanoscale Res. Lett"},{"key":"2026092911113274100_cit53","doi-asserted-by":"publisher","first-page":"158857","DOI":"10.1016\/j.apsusc.2023.158857","article-title":"Facilitated fluorination\nand etching of 2D materials","volume":"645","author":"Shin","year":"2024","journal-title":"Appl. Surf. Sci."},{"issue":"7","key":"2026092911113274100_cit54","doi-asserted-by":"publisher","first-page":"1500413","DOI":"10.1002\/advs.201500413","article-title":"Two-Dimensional Fluorinated\nGraphene: Synthesis, Structures, Properties and Applications","volume":"3","author":"Feng","year":"2016","journal-title":"Adv. Sci"},{"key":"2026092911113274100_cit55","doi-asserted-by":"publisher","first-page":"722","DOI":"10.1038\/nnano.2010.172","article-title":"Boron nitride substrates for high-quality\ngraphene electronics","volume":"5","author":"Dean","year":"2010","journal-title":"Nat. Nanotechnol"},{"key":"2026092911113274100_cit56","doi-asserted-by":"publisher","first-page":"1883","DOI":"10.1021\/nl803883h","article-title":"Energy Dissipation\nin Graphene Field-Effect Transistors","volume":"9","author":"Freitag","year":"2009","journal-title":"Nano Lett"},{"key":"2026092911113274100_cit57","doi-asserted-by":"publisher","first-page":"226801","DOI":"10.1103\/PhysRevLett.95.226801","article-title":"Quantum Spin Hall\nEffect in Graphene","volume":"95","author":"Kane","year":"2005","journal-title":"Phys. Rev. Lett"},{"key":"2026092911113274100_cit58","doi-asserted-by":"publisher","first-page":"076802","DOI":"10.1103\/PhysRevLett.107.076802","article-title":"Quantum Spin\nHall Effect in Silicene\nand Two-Dimensional Germanium","volume":"107","author":"Liu","year":"2011","journal-title":"Phys. Rev. Lett"},{"key":"2026092911113274100_cit59","doi-asserted-by":"publisher","first-page":"24","DOI":"10.1016\/j.pmatsci.2016.04.001","article-title":"Rise of silicene: A competitive 2D material","volume":"83","author":"Zhao","year":"2016","journal-title":"Prog. Mater. Sci"},{"key":"2026092911113274100_cit60","doi-asserted-by":"publisher","first-page":"025031","DOI":"10.1088\/2053-1591\/aaeea3","article-title":"Spin orbit coupling induced band gap in gemanene modulated\nby external\nfield","volume":"6","author":"Li","year":"2019","journal-title":"Mater. Res. Express"},{"key":"2026092911113274100_cit61","doi-asserted-by":"publisher","first-page":"118","DOI":"10.1016\/j.spmi.2017.04.012","article-title":"Investigation of electronic properties\nand spin-orbit\ncoupling effects on passivated stanene nanosheet: A first-principles\nstudy","volume":"107","author":"Nagarajan","year":"2017","journal-title":"Superlattices Microstruct"},{"issue":"26","key":"2026092911113274100_cit62","doi-asserted-by":"publisher","first-page":"2007862","DOI":"10.1002\/adma.202007862","article-title":"Strain\nEffects on Rashba Spin-Orbit Coupling of 2D Hole Gases in GeSn\/Ge\nHeterostructures","volume":"33","author":"Tai","year":"2021","journal-title":"Adv. Mater"},{"key":"2026092911113274100_cit63","doi-asserted-by":"publisher","first-page":"8608","DOI":"10.1039\/C7NR00688H","article-title":"Two-dimensional germanium monochalcogenide photocatalyst for water\nsplitting under ultraviolet, visible to near-infrared light","volume":"9","author":"Ji","year":"2017","journal-title":"Nanoscale"},{"key":"2026092911113274100_cit64","doi-asserted-by":"publisher","first-page":"014001","DOI":"10.1103\/PhysRevMaterials.7.014001","article-title":"Electronic and optical properties of Janus-like hexagonal\nmonolayer materials of group IV-VI","volume":"7","author":"Barbosa","year":"2023","journal-title":"Phys. Rev.\nMater"},{"key":"2026092911113274100_cit65","doi-asserted-by":"publisher","first-page":"931","DOI":"10.1021\/acs.nanolett.0c03412","article-title":"Excitonic Dynamics in Janus MoSSe\nand WSSe Monolayers","volume":"21","author":"Zheng","year":"2021","journal-title":"Nano Lett"},{"key":"2026092911113274100_cit66","doi-asserted-by":"publisher","first-page":"3123","DOI":"10.1021\/acs.jpcc.7b11584","article-title":"Janus Structures\nof Transition Metal Dichalcogenides\nas the Heterojunction Photocatalysts for Water Splitting","volume":"122","author":"Ji","year":"2018","journal-title":"J. Phys. Chem. C"}],"container-title":["ACS Omega"],"original-title":[],"language":"en","link":[{"URL":"https:\/\/pubs.acs.org\/doi\/pdf\/10.1021\/acsomega.6c04011","content-type":"application\/pdf","content-version":"vor","intended-application":"unspecified"},{"URL":"https:\/\/pubs.acs.org\/acsodf\/article-pdf\/11\/38\/57004\/68110801\/acsomega.6c04011.pdf","content-type":"application\/pdf","content-version":"vor","intended-application":"syndication"},{"URL":"https:\/\/pubs.acs.org\/acsodf\/article-pdf\/11\/38\/57004\/68110801\/acsomega.6c04011.pdf","content-type":"unspecified","content-version":"vor","intended-application":"similarity-checking"}],"deposited":{"date-parts":[[2026,9,29]],"date-time":"2026-09-29T15:50:25Z","timestamp":1790697025000},"score":1,"resource":{"primary":{"URL":"https:\/\/pubs.acs.org\/acsodf\/article\/11\/38\/57004\/5396672\/Fluorination-Effects-in-Hexagonal-XY-X-Y-C-Ge-Si"}},"subtitle":[],"short-title":[],"issued":{"date-parts":[[2026,9,1]]},"references-count":66,"journal-issue":{"issue":"38","published-online":{"date-parts":[[2026,9,1]]},"published-print":{"date-parts":[[2026,9,29]]}},"URL":"https:\/\/doi.org\/10.1021\/acsomega.6c04011","relation":{},"ISSN":["2470-1343"],"issn-type":[{"value":"2470-1343","type":"electronic"}],"subject":[],"published":{"date-parts":[[2026,9,1]]}}}