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Starting with a minimal five\u2010band tight\u2010binding model, all the topological states are sorted into five groups, which are determined by the interlayer and intralayer hopping parameters. Combined with the model, an algorithm is designed to obtain a series of experimentally synthesized topological semimetals with kagome and honeycomb layers, i.e., IAMX family (IA = Alkali metal element, M = Rare earth metal element, X = Carbon group element), in the inorganic crystal structure database. A follow\u2010up high\u2010throughput calculation shows that IAMX family materials are all nodal\u2010line semimetals and they will be Weyl semimetals after taking spin\u2010orbit coupling into consideration. To have further insights into the topology of the IAMX family, a detailed chemical rule analysis is carried out on the high\u2010throughput calculations, including the lattice constants of the structure, intralayer and interlayer couplings, bond strengths, electronegativity, and so on, which are consistent with the tight\u2010binding model. This study provides a way to discover and modulate topological properties in stacked kagome and honeycomb crystals and offers candidates for studying topology\u2010related properties like topological superconductors and axion\u00a0insulators.<\/jats:p>","DOI":"10.1002\/adma.202309803","type":"journal-article","created":{"date-parts":[[2024,1,28]],"date-time":"2024-01-28T05:59:08Z","timestamp":1706421548000},"update-policy":"https:\/\/doi.org\/10.1002\/crossmark_policy","source":"Crossref","is-referenced-by-count":13,"title":["Chemical Rules for Stacked Kagome and Honeycomb Topological Semimetals"],"prefix":"10.1002","volume":"36","author":[{"ORCID":"https:\/\/orcid.org\/0000-0002-7415-2846","authenticated-orcid":false,"given":"Liqin","family":"Zhou","sequence":"first","affiliation":[{"name":"Beijing National Laboratory for Condensed Matter Physics and Institute of Physics Chinese Academy of Sciences Beijing 100190 China"}],"role":[{"vocabulary":"crossref","role":"author"}]},{"given":"Fazhi","family":"Yang","sequence":"additional","affiliation":[{"name":"Beijing National Laboratory for Condensed Matter Physics and Institute of Physics Chinese Academy of Sciences Beijing 100190 China"}],"role":[{"vocabulary":"crossref","role":"author"}]},{"given":"Shuai","family":"Zhang","sequence":"additional","affiliation":[{"name":"Institute of Theoretical Physics Chinese Academy of Sciences Beijing 100190 China"}],"role":[{"vocabulary":"crossref","role":"author"}]},{"given":"Tiantian","family":"Zhang","sequence":"additional","affiliation":[{"name":"Institute of Theoretical Physics Chinese Academy of Sciences Beijing 100190 China"}],"role":[{"vocabulary":"crossref","role":"author"}]}],"member":"311","published-online":{"date-parts":[[2024,2,7]]},"reference":[{"key":"e_1_2_8_1_1","doi-asserted-by":"publisher","DOI":"10.1103\/RevModPhys.81.109"},{"key":"e_1_2_8_2_1","doi-asserted-by":"publisher","DOI":"10.1038\/nmat1849"},{"key":"e_1_2_8_3_1","doi-asserted-by":"publisher","DOI":"10.1038\/nnano.2013.161"},{"key":"e_1_2_8_4_1","doi-asserted-by":"publisher","DOI":"10.1103\/PhysRevLett.106.116803"},{"key":"e_1_2_8_5_1","doi-asserted-by":"publisher","DOI":"10.1103\/PhysRevLett.106.156402"},{"key":"e_1_2_8_6_1","doi-asserted-by":"publisher","DOI":"10.1103\/PhysRevB.104.045139"},{"key":"e_1_2_8_7_1","doi-asserted-by":"publisher","DOI":"10.1103\/PhysRevB.92.045108"},{"key":"e_1_2_8_8_1","doi-asserted-by":"publisher","DOI":"10.1143\/ptp\/6.3.306"},{"key":"e_1_2_8_9_1","doi-asserted-by":"publisher","DOI":"10.1021\/jacs.2c04183"},{"key":"e_1_2_8_10_1","doi-asserted-by":"publisher","DOI":"10.1038\/s41586-022-05516-0"},{"key":"e_1_2_8_11_1","doi-asserted-by":"publisher","DOI":"10.1038\/s41567-021-01404-y"},{"key":"e_1_2_8_12_1","doi-asserted-by":"publisher","DOI":"10.1103\/PhysRevResearch.5.043231"},{"key":"e_1_2_8_13_1","doi-asserted-by":"publisher","DOI":"10.1103\/PhysRevB.104.054305"},{"key":"e_1_2_8_14_1","doi-asserted-by":"publisher","DOI":"10.1103\/PhysRevB.87.115135"},{"key":"e_1_2_8_15_1","doi-asserted-by":"publisher","DOI":"10.1103\/PhysRevB.85.144402"},{"key":"e_1_2_8_16_1","doi-asserted-by":"publisher","DOI":"10.1103\/PhysRevLett.127.046401"},{"key":"e_1_2_8_17_1","doi-asserted-by":"publisher","DOI":"10.1103\/PhysRevLett.110.126405"},{"key":"e_1_2_8_18_1","doi-asserted-by":"publisher","DOI":"10.1103\/PhysRevB.80.113102"},{"key":"e_1_2_8_19_1","doi-asserted-by":"publisher","DOI":"10.1126\/science.aav2873"},{"key":"e_1_2_8_20_1","doi-asserted-by":"publisher","DOI":"10.1126\/science.aav2334"},{"key":"e_1_2_8_21_1","doi-asserted-by":"publisher","DOI":"10.1038\/s41586-018-0502-7"},{"key":"e_1_2_8_22_1","doi-asserted-by":"publisher","DOI":"10.1038\/s41567-019-0426-7"},{"key":"e_1_2_8_23_1","doi-asserted-by":"publisher","DOI":"10.1038\/nature25987"},{"key":"e_1_2_8_24_1","doi-asserted-by":"publisher","DOI":"10.1126\/science.1201080"},{"key":"e_1_2_8_25_1","volume":"6","author":"Kelly Z. 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