Search Results - "Openov, L. A."

Hydrogen Desorption from Pentagraphane by Openov, L. A., Podlivaev, A. I.

“…Thermally activated hydrogen desorption from pentagraphane is studied by atomistic computer simulation. Pentagraphane is a recently predicted…”
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On the Thermal Stability of Some Quasi-Fullerenes by Podlivaev, A. I., Openov, L. A.

“…The thermal stability of recently predicted quasi-fullerenes С 20 , С 42 , С 48 , and С 60 is studied by the method of molecular dynamics. The routes of their…”
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Disordering in Stone—Wales Graphene at High Temperatures by Openov, L. A., Podlivaev, A. I.

“…Thermally activated structural disordering is numerically studied in Stone—Wales graphene, which is a recently predicted new allotropic modification of…”
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On the Thermal Stability of Pentagraphene by Openov, L. A., Podlivaev, A. I.

“…In the framework of the nonorthogonal tight-binding model, the thermal stability of pentagraphene is studied by numerical simulation using the molecular…”
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Comment on "Universal decoherence in solids" by Openov, L A

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Thermal stability of diamond-like carbon nanothreads by Openov, L. A., Podlivaev, A. I.

“…The thermally activated fracture processes in the carbon backbone of diamond-like carbon nanothreads and the hydrogen desorption from them has been studied by…”
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C–C20 Carbyne–Carbinofullerene Chains by Openov, L. A., Podlivaev, A. I.

“…The results of computer simulation of a new one-dimensional carbon structure representing chains composed of C 20 carbinofullerene fragments linked with carbon…”
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Elementary defects in graphane by Podlivaev, A. I., Openov, L. A.

“…The main zero-dimensional defects in graphane, a completely hydrogenated single-layer graphene, having the chair-type conformation have been numerically…”
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Thermal annealing of Stone–Wales defects in fullerenes and nanotubes by Podlivaev, A. I., Openov, L. A.

“…The thermally activated annealing of topological Stone–Wales defects in carbon fullerenes and nanotubes is studied via molecular dynamics. The temperature…”
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Negative Poisson’s ratio in a nonplanar phagraphene by Openov, L. A., Podlivaev, A. I.

“…This paper has presented the results of the numerical simulation of the elastic properties of phagraphene—a recently predicted quasi-two-dimensional allotrope…”
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Effect of Hydrogen Adsorption on the Stone–Wales Transformation in Small-Diameter Carbon Nanotubes by Openov, L. A., Podlivaev, A. I.

“…The effect of hydrogenation of (4, 0) and (3, 0) carbon nanotubes on the Stone–Wales transformation is studied in the framework of the nonorthogonal…”
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C20 Carbinofullerene Chains by Podlivaev, A. I., Openov, L. A.

“…The results of computer simulation of a new one-dimensional carbon structure representing chains composed of C 20 carbinofullerenes are presented. Their…”
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Effect of the Dehydrogenation of Graphane on Its Mechanical and Electronic Properties by Openov, L. A., Podlivaev, A. I.

“…The effect of the desorption of hydrogen on the mechanical characteristics and electronic structure of the armchair conformation of graphane is studied in the…”
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Effect of hydrogen desorption on the mechanical properties and electron structure of diamond-like carbon nanothreads by Podlivaev, A. I., Openov, L. A.

“…The effect of hydrogen desorption on the mechanical stiffness, intrinsic vibrational spectrum, and electron density of states in structurally diamond-like…”
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Thermal stability of hydrogenated small-diameter carbon nanotubes by Podlivaev, A. I., Openov, L. A.

“…The initial stage of hydrogen desorption from fully hydrogenated carbon nanotubes (3.0) and (2.2) is numerically studied by the molecular dynamics method. The…”
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Nonorthogonal tight-binding model for hydrocarbons by Maslov, M.M., Podlivaev, A.I., Openov, L.A.

“…Parameters of the nonorthogonal tight-binding model for hydrocarbons are derived based on a criterion of the best agreement between the calculated and…”
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Spontaneous regeneration of an atomically sharp graphene/graphane interface under thermal disordering by Openov, L. A., Podlivaev, A. I.

“…The smearing of the graphene/graphane interface owing to the thermally activated migration of hydrogen atoms has been investigated by the molecular dynamics…”
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Thermal stability of single-side hydrogenated graphene by Openov, L. A., Podlivaev, A. I.

“…The temperature dependence of the time of hydrogen desorption from single-side hydrogenated graphene is calculated using molecular dynamics simulation. The…”
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Clusters of interstitial carbon atoms near the graphite surface as a possible origin of dome-like features observed by scanning tunneling microscopy by Elesin, V.F., Openov, L.A.

“…Formation of clusters of interstitial carbon atoms between the surface and second atomic layers of graphite is demonstrated by means of molecular dynamics…”
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Stability of C20 fullerene chains by Openov, L. A., Davydov, I. V., Podlivaev, A. I.

“…The stability of (C20)N metastable chains, where C20 fullerenes are joined by tight covalent bonds, is analyzed by numerical simulation using a tight-binding…”
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