Two-dimensional crystal phases of graphene monoxide

[1]  M. Weinert,et al.  Interaction of Lithium with a Monolayer of Graphene Monoxide , 2021 .

[2]  Carlo Cavazzoni,et al.  Quantum ESPRESSO toward the exascale. , 2020, The Journal of chemical physics.

[3]  A. Ramazani,et al.  A First-Principles Study of Nonlinear Elastic Behavior and Anisotropic Electronic Properties of Two-Dimensional HfS2 , 2020, Nanomaterials.

[4]  A. Lebedev,et al.  Comparison of performance of van der Waals-corrected exchange-correlation functionals for interlayer interaction in graphene and hexagonal boron nitride , 2017, 1708.01504.

[5]  K. Knowles.  The Biaxial Moduli of Cubic Materials Subjected to an Equi-biaxial Elastic Strain , 2016 .

[6]  Yong-Chae Chung,et al.  Graphene Monoxide Bilayer As a High-Performance on/off Switching Media for Nanoelectronics. , 2016, ACS applied materials & interfaces.

[7]  A. D. Corso.  Pseudopotentials periodic table: From H to Pu , 2014 .

[8]  G. Cao.  Atomistic Studies of Mechanical Properties of Graphene , 2014 .

[9]  M. Weinert,et al.  Revealing the substrate origin of the linear dispersion of silicene/Ag(111). , 2014, Nano letters.

[10]  M. Weinert,et al.  First-principles studies on infrared properties of semiconducting graphene monoxide , 2013 .

[11]  M. Weinert,et al.  Anisotropic thermal conductivity of semiconducting graphene monoxide , 2013 .

[12]  G. Kalosakas,et al.  In-plane force fields and elastic properties of graphene , 2012, 1211.5095.

[13]  M. Weinert,et al.  Evidence of nanocrystalline semiconducting graphene monoxide during thermal reduction of graphene oxide in vacuum. , 2011, ACS nano.

[14]  Stefan Grimme,et al.  Effect of the damping function in dispersion corrected density functional theory , 2011, J. Comput. Chem..

[15]  Kyeongjae Cho,et al.  The role of intercalated water in multilayered graphene oxide. , 2010, ACS nano.

[16]  Y. Chabal,et al.  Unusual infrared-absorption mechanism in thermally reduced graphene oxide. , 2010, Nature materials.

[17]  R. Ruoff,et al.  Graphene and Graphene Oxide: Synthesis, Properties, and Applications , 2010, Advanced materials.

[18]  S. Grimme,et al.  A consistent and accurate ab initio parametrization of density functional dispersion correction (DFT-D) for the 94 elements H-Pu. , 2010, The Journal of chemical physics.

[19]  M. Ceppatelli,et al.  High-pressure reactivity of model hydrocarbons driven by near-UV photodissociation of water. , 2009, The journal of physical chemistry. B.

[20]  Stefano de Gironcoli,et al.  QUANTUM ESPRESSO: a modular and open-source software project for quantum simulations of materials , 2009, Journal of physics. Condensed matter : an Institute of Physics journal.

[21]  K. Michel,et al.  Theory of the elastic constants of graphite and graphene , 2008 .

[22]  W. Ludwig,et al.  Observations of Intergranular Stress Corrosion Cracking in a Grain-Mapped Polycrystal , 2008, Science.

[23]  R. Maxwell,et al.  Pressure-Induced Polymerization of Carbon Monoxide: Disproportionation and Synthesis of an Energetic Lactonic Polymer , 2006 .

[24]  W. Evans,et al.  High-energy-density extended CO solid , 2005, Nature materials.

[25]  Olle Eriksson,et al.  Density functional theory for calculation of elastic properties of orthorhombic crystals: Application to TiSi2 , 1998 .

[26]  G. Herzberg,et al.  Molecular Spectra and Molecular Structure , 1992 .

[27]  R. L. Mills,et al.  Structures and phase diagrams of N2 and CO to 13 GPa by x‐ray diffraction , 1986 .

[28]  R. L. Mills,et al.  NEW PHASES AND CHEMICAL REACTIONS IN SOLID CO UNDER PRESSURE , 1984 .

[29]  R. L. Mills,et al.  New phases and chemical reactions in solid carbon monoxide under pressure , 1984 .

[30]  R. L. Mills,et al.  alpha-gamma Transition in Solid Nitrogen and Carbon Monoxide at High Pressure , 1971 .

[31]  R. Bartlett,et al.  Crystal orbital study of polycarbonyl , 2003 .

[32]  M. Kertész,et al.  Can carbon monoxide polymerize? A theoretical investigation of polyketone , 1997 .