Gap openings in graphene regarding interfacial interaction from substrates
文献情報
Y. F. Zhu, Q. Q. Dai, W. T. Zheng, Q. Jiang
Based on the size-dependent cohesive energy formula for two-dimensional materials, we investigate the gap openings in graphene layers regarding distinct interfacial interaction from substrates. Depending on the interfacial physicochemical nature, the gap is opened weakly induced by the van der Waals interaction but readily by the chemical bonding. Relative to the former, in essence, the distinct opening behavior for the latter comes from the substantial change in atomic cohesive energy of graphene associated with the coordination imperfection. Our predictions agree with the available experimental or computer simulation results for graphene layers on layered BN or bulk truncated SiC. The present work is of benefit for the application of graphene in electronics.
関連文献
Zeolites for the selective adsorption of sulfur hexafluoride
I. Matito-Martos, J. Álvarez-Ossorio, J. J. Gutiérrez-Sevillano, M. Doblaré, A. Martin-Calvo, S. Calero
DOI: 10.1039/C5CP02407B
How does the plasmonic enhancement of molecular absorption depend on the energy gap between molecular excitation and plasmon modes: a mixed TDDFT/FDTD investigation
Jin Sun, Guang Li, WanZhen Liang
DOI: 10.1039/C5CP00846H
A first-principles study on the magnetic properties of nonmetal atom doped phosphorene monolayers
Huiling Zheng, Jianmin Zhang, Xiaobo Du, Yu Yan
DOI: 10.1039/C5CP00916B
Comparing the electronic relaxation dynamics of aniline and d7-aniline following excitation at 272–238 nm
Oliver M. Kirkby, Matthieu Sala, Garikoitz Balerdi, Rebeca de Nalda, Luis Bañares, Stéphane Guérin, Helen H. Fielding
DOI: 10.1039/C5CP01883H
Incorporating a hole-transport material into the emissive layer of solid-state light-emitting electrochemical cells to improve device performance
Po-Chin Huang, Gintare Krucaite, Hai-Ching Su, Saulius Grigalevicius
DOI: 10.1039/C5CP02034D
In situ site-selective transition metal K-edge XAS: a powerful probe of the transformation of mixed-valence compounds
Amélie Bordage, Virgile Trannoy, Hugo Vitoux, Robinson Moulin, Anne Bleuzen
DOI: 10.1039/C5CP02591E
Electronic and magnetic properties of DUT-8(Ni)
Kai Trepte, Sebastian Schwalbe, Gotthard Seifert
DOI: 10.1039/C5CP01881A
Exfoliated carbon nitride nanosheets decorated with NiS as an efficient noble-metal-free visible-light-driven photocatalyst for hydrogen evolution
Yongtao Lu, Dongmei Chu, Mingshan Zhu, Yukou Du, Ping Yang
DOI: 10.1039/C5CP01657F
Impacts of retinal polyene (de)methylation on the photoisomerization mechanism and photon energy storage of rhodopsin
Elżbieta Walczak, Tadeusz Andruniów
DOI: 10.1039/C5CP01939G
Bistable electrical switching and nonvolatile memory effect in carbon nanotube–poly(3,4-ethylenedioxythiophene):poly(styrenesulfonate) composite films
Lei Li, Dianzhong Wen, Xuduo Bai, Gang Li
DOI: 10.1039/C5CP02164B
こちらもおすすめ
2-ヒドロキシ-5-ニトロベンジンブロモイドの代替品はありますか?
2-ヒドロキシ-5-ニトロベンジンブロモイドは特定の化学反応に適しているため、代替品は限られています。しかし、同様の構造を持つ2-ヒドロキシ-4-ニトロベンジン...
N-(2-ブロモフェニル)-1-チロール-3-オキソ-3-(ピペリジニル)プロペン-2-イル)ベンゼンアミドを取り扱う際の実験室安全事項は何ですか?
N-(2-ブロモフェニル)-1-チロール-3-オキソ-3-(ピペリジニル)プロペン-2-イル)ベンゼンアミドは有毒で、皮膚や粘膜に刺激を与える可能性があります。...
1,3プロパンジオール,2-[2-(2アミノ-6クロロ-9Hピリミジン-9-イル)エチル-1,1,2,2-D4]-2,3-ジアセタートの市場動向や研究トレンドはどうですか?
この化合物は、新規治療薬の開発に注目されています。市場では、その有効性と安全性が評価され、研究分野では、分子生物学と医薬化学の新たな発見が期待されています。
Succinimidyl-alanyl-phenylalanyl-prolyl-phenylalanine 4-nitroanilide はどの業界で使用されていますか?
Succinimidyl-alanyl-phenylalanyl-prolyl-phenylalanine 4-nitroanilide は主に医薬品開発やポ...
メチル6-アミノ-5-クロロピリジン-2-カーボイル酸について、適用される法規ガイドラインは何ですか?
メチル6-アミノ-5-クロロピリジン-2-カーボイル酸(CAS番号: 1256794-05-4)の使用には、GHS( Globally Harmonized S...
エチル4-(シクロ Pentagonyl)アミノ-2-メチル硫化基ピリミジン-5-カルボキシレートを取り扱う際の実験室安全事項は何ですか?
取り扱いには、耐薬品性の容器を使用し、通気性の良い場所で操作することを推奨します。漏れ時は、SDS(安全データシート)を参照して適切な措置を取ること。手洗いと洗...
(S)-3-ベンZYルピペリジン塩酸塩とは何ですか?
(S)-3-ベンZYルピペリジン塩酸塩は、CAS番号1258940-00-9で表される化合物です。これは、(S)-3-苯基哌啶的盐酸盐であり、主に医薬品の原料と...
3,5-二甲基金剛胺の主な用途は何ですか?
3,5-二甲基金剛胺は、主に医薬品の原料として使用され、また抗うつ薬や抗アルツハイマー薬の開発に利用されます。さらに、化粧品や食品添加物の製造でも重要な役割を果...
ビス(4-メチル-2-ペンチル)フェニルカルボン酸エステルの代替品はありますか?
ビス(4-メチル-2-ペンチル)フェニルカルボン酸エステル (CAS番号: 1398066-13-1) の代替品には、ビス(2-エチルヘキシル)フェノールカルボ...
掲載誌
Physical Chemistry Chemical Physics

Physical Chemistry Chemical Physics (PCCP) is an international journal co-owned by 19 physical chemistry and physics societies from around the world. This journal publishes original, cutting-edge research in physical chemistry, chemical physics and biophysical chemistry. To be suitable for publication in PCCP, articles must include significant innovation and/or insight into physical chemistry; this is the most important criterion that reviewers and Editors will judge against when evaluating submissions. The journal has a broad scope and welcomes contributions spanning experiment, theory, computation and data science. Topical coverage includes spectroscopy, dynamics, kinetics, statistical mechanics, thermodynamics, electrochemistry, catalysis, surface science, quantum mechanics, quantum computing and machine learning. Interdisciplinary research areas such as polymers and soft matter, materials, nanoscience, energy, surfaces/interfaces, and biophysical chemistry are welcomed if they demonstrate significant innovation and/or insight into physical chemistry. Joined experimental/theoretical studies are particularly appreciated when complementary and based on up-to-date approaches.














![2,2'-[(Abieta-8,11,13-trien-18-ylimino)bis(2,1-ethanediyloxy)]diethanol structure 2,2'-[(Abieta-8,11,13-trien-18-ylimino)bis(2,1-ethanediyloxy)]diethanol structure](https://static.chemtradehub.com/structs/513/51344-62-8-8518.webp)