标题
On the physisorption of water on graphene: a CCSD(T) study
作者
关键词
-
出版物
PHYSICAL CHEMISTRY CHEMICAL PHYSICS
Volume 13, Issue 25, Pages 12041
出版商
Royal Society of Chemistry (RSC)
发表日期
2011-05-31
DOI
10.1039/c1cp20609e
参考文献
相关参考文献
注意:仅列出部分参考文献,下载原文获取全部文献信息。- Graphene on ferromagnetic surfaces and its functionalization with water and ammonia
- (2011) Stefan Böttcher et al. Nanoscale Research Letters
- Second-order Møller–Plesset perturbation theory applied to extended systems. II. Structural and energetic properties
- (2010) Andreas Grüneis et al. JOURNAL OF CHEMICAL PHYSICS
- A consistent and accurate ab initio parametrization of density functional dispersion correction (DFT-D) for the 94 elements H-Pu
- (2010) Stefan Grimme et al. JOURNAL OF CHEMICAL PHYSICS
- High-speed graphene transistors with a self-aligned nanowire gate
- (2010) Lei Liao et al. NATURE
- Roll-to-roll production of 30-inch graphene films for transparent electrodes
- (2010) Sukang Bae et al. Nature Nanotechnology
- Benchmark calculations of water–acene interaction energies: Extrapolation to the water–graphene limit and assessment of dispersion–corrected DFT methods
- (2010) Glen R. Jenness et al. PHYSICAL CHEMISTRY CHEMICAL PHYSICS
- DFT/CC investigation of physical adsorption on a graphite (0001) surface
- (2010) Miroslav Rubeš et al. PHYSICAL CHEMISTRY CHEMICAL PHYSICS
- Development of a Wavefunction-basedAb InitioMethod for Metals Applying the Method of Increments
- (2010) Elena Voloshina et al. ZEITSCHRIFT FUR PHYSIKALISCHE CHEMIE-INTERNATIONAL JOURNAL OF RESEARCH IN PHYSICAL CHEMISTRY & CHEMICAL PHYSICS
- Second Order Local Møller-Plesset Perturbation Theory for Periodic Systems: the CRYSCOR Code
- (2010) Denis Usvyat et al. ZEITSCHRIFT FUR PHYSIKALISCHE CHEMIE-INTERNATIONAL JOURNAL OF RESEARCH IN PHYSICAL CHEMISTRY & CHEMICAL PHYSICS
- Electron correlation contribution to the /ceria(111) interaction
- (2009) Carsten Müller et al. CHEMICAL PHYSICS
- JuNoLo – Jülich nonlocal code for parallel post-processing evaluation of vdW-DF correlation energy
- (2009) Predrag Lazić et al. COMPUTER PHYSICS COMMUNICATIONS
- Application of the method of increments to the adsorption of H2S on graphene
- (2009) Beate Paulus et al. INTERNATIONAL JOURNAL OF QUANTUM CHEMISTRY
- Structure and Stability of the Water−Graphite Complexes
- (2009) Miroslav Rubeš et al. Journal of Physical Chemistry C
- Chemical functionalization of graphene
- (2009) D W Boukhvalov et al. JOURNAL OF PHYSICS-CONDENSED MATTER
- First-principles study of the interaction and charge transfer between graphene and metals
- (2009) P. A. Khomyakov et al. PHYSICAL REVIEW B
- Graphene: Status and Prospects
- (2009) A. K. Geim SCIENCE
- Ab initio calculations of CO physisorption on ceria(111)
- (2009) Carsten Müller et al. SURFACE SCIENCE
- First-principles studies of water adsorption on graphene: The role of the substrate
- (2008) Tim O. Wehling et al. APPLIED PHYSICS LETTERS
- Periodic local MP2 method for the study of electronic correlation in crystals: Theory and preliminary applications
- (2008) Cesare Pisani et al. JOURNAL OF COMPUTATIONAL CHEMISTRY
- Fitting of local densities in periodic systems
- (2008) Lorenzo Maschio et al. PHYSICAL REVIEW B
- Inducing energy gaps in monolayer and bilayer graphene: Local density approximation calculations
- (2008) R. M. Ribeiro et al. PHYSICAL REVIEW B
- Adsorption ofH2O,NH3, CO,NO2, and NO on graphene: A first-principles study
- (2008) O. Leenaerts et al. PHYSICAL REVIEW B
- The non-covalent functionalisation of carbon nanotubes studied by density functional and semi-empirical molecular orbital methods including dispersion corrections
- (2007) Jonathan P. McNamara et al. PHYSICAL CHEMISTRY CHEMICAL PHYSICS
Find Funding. Review Successful Grants.
Explore over 25,000 new funding opportunities and over 6,000,000 successful grants.
ExploreCreate your own webinar
Interested in hosting your own webinar? Check the schedule and propose your idea to the Peeref Content Team.
Create Now