Lista de obras -

A Simple Method of the Determination of the Structural Heterogeneity of Microporous Solids

artículo científico publicado en 2001

Activated carbon immersed in water-the origin of linear correlation between enthalpy of immersion and oxygen content studied by molecular dynamics simulation

artículo científico publicado en 2010

Adsorption energy distribution from the Aranovich-Donohue lattice density functional theory.

artículo científico publicado en 2004

Adsorption from aqueous solutions on opened carbon nanotubes--organic compounds speed up delivery of water from inside

artículo científico publicado en 2009

Adsorption potential distributions for carbons having defined pore structure—GCMC simulations of the effect of heterogeneity

artículo científico publicado en 2009

Adsorption-induced deformation of microporous carbons: pore size distribution effect.

artículo científico publicado en 2008

Ammonium sorption from aqueous solutions by the natural zeolite Transcarpathian clinoptilolite studied under dynamic conditions

scientific article published on 01 April 2005

Applicability of molecular simulations for modelling the adsorption of the greenhouse gas CF4 on carbons.

artículo científico publicado en 2012

Ar, CCl(4) and C(6)H(6) adsorption outside and inside of the bundles of multi-walled carbon nanotubes-simulation study.

artículo científico publicado en 2009

BET surface area of carbonaceous adsorbents—Verification using geometric considerations and GCMC simulations on virtual porous carbon models

artículo científico publicado en 2010

Benzene adsorption on carbonaceous materials: The influence of pore structure on the state of the adsorbate

artículo científico publicado en 2006

Bimodal pore size distributions for carbons: experimental results and computational studies.

artículo científico publicado en 2007

CO2 - Reinforced nanoporous carbon potential energy field during CO2/CH4 mixture adsorption. A comprehensive volumetric, in-situ IR, and thermodynamic insight

artículo científico publicado en 2017

Can carbon surface oxidation shift the pore size distribution curve calculated from Ar, N2and CO2adsorption isotherms? Simulation results for a realistic carbon model ⬇️

artículo científico publicado el 7 de julio de 2009

Carbon Dioxide Adsorption-Induced Deformation of Microporous Carbons

artículo científico publicado en 2010

Carbon Molecular Sieves: Reconstruction of Atomistic Structural Models with Experimental Constraints

artículo científico publicado en 2014

Carbon Nanohorns as Reaction Nanochambers - a Systematic Monte Carlo Study

artículo científico publicado en 2018

Carbon materials as new nanovehicles in hot-melt drug deposition.

artículo científico publicado en 2013

Characterization of Microporous Carbon Materials by Means of a New Gamma-Type Adsorption Isotherm Equation

artículo científico publicado en 2001

Constant Pressure Path Integral Gibbs Ensemble Monte Carlo Method.

artículo científico publicado en 2013

Cryogenic Helium Adsorbed in Zeolite Rho: Inside Localization Controlled Self-Diffusion of Confined Quantum Particles

artículo científico publicado en 2011

Cryogenic Noble Gas Separation without Distillation: The Effect of Carbon Surface Curvature on Adsorptive Separation

artículo científico publicado en 2012

Cryogenic separation of hydrogen isotopes in single-walled carbon and boron-nitride nanotubes: insight into the mechanism of equilibrium quantum sieving in quasi-one-dimensional pores

artículo científico publicado en 2008

Description of benzene adsorption in slit-like pores. Theoretical foundations of the improved Horvath–Kawazoe method

artículo científico publicado en 2004

Detecting adsorption space in carbon nanotubes by benzene uptake

scientific article published on 04 October 2012

Determination of Isosteric Heat of Adsorption by Quenched Solid Density Functional Theory.

artículo científico publicado en 2017

Developing the solution analogue of the Toth adsorption isotherm equation.

artículo científico publicado en 2003

Displacement of Methane by Coadsorbed Carbon Dioxide Is Facilitated In Narrow Carbon Nanopores

artículo científico publicado en 2012

Distribution of carbon nanotube sizes from adsorption measurements and computer simulation

artículo científico publicado en 2005

Effect of the carbon surface layer chemistry on benzene adsorption from the vapor phase and from dilute aqueous solutions

artículo científico publicado en 2005

Effects of Critical Fluctuations on Adsorption-Induced Deformation of Microporous Carbons

artículo científico publicado en 2015

Efficient adsorption of super greenhouse gas (tetrafluoromethane) in carbon nanotubes.

artículo científico publicado en 2008

Elastic properties of cancellous bone derived from finite element models of parameterized microstructure cells

artículo científico publicado en 2003

Enhanced geometric model for numerical microstructure analysis of plain-weave fabric-reinforced composite

journal article; published in Advanced Composite Materials in 2015

Equilibrium clusters in concentrated lysozyme protein solutions ⬇️

artículo científico publicado el 22 de julio de 2011

Estimating the pore size distribution of activated carbons from adsorption data of different adsorbates by various methods

artículo científico publicado en 2004

Estimation of the pore-size distribution function from the nitrogen adsorption isotherm. Comparison of density functional theory and the method of Do and co-workers

artículo científico publicado en 2003

Evaluation of the Structural and Energetic Heterogeneity of Microporous Carbons by Means of Novel Numerical Methods and Genetic Algorithms

artículo científico publicado en 2002

Folding of graphene slit like pore walls--a simple method of improving CO2 separation from mixtures with CH4 or N2

scientific article published on 29 October 2014

Frequency-Dependent Diffusion Constant of Quantum Fluids from Path Integral Monte Carlo and Tikhonov's Regularizing Functional

artículo científico publicado en 2009

Fullerene-Intercalated Graphene Nano-Containers — Mechanism of Argon Adsorption and High-Pressure CH 4 and CO 2 Storage Capacities

artículo científico publicado en 2009

Grand Canonical Monte Carlo Simulation Study of Hydrogen Storage in Ordered Mesoporous Carbons at 303 K

artículo científico publicado en 2006

Grand canonical monte carlo simulation study of methane adsorption at an open graphite surface and in slit-like carbon pores at 273 K

artículo científico publicado en 2005

Heterogeneity on high-resolution alpha(s) plots for carbon nanotubes-GCMC study

scientific article published on 07 July 2008

Heterogeneous Do-Do model of water adsorption on carbons

scientific article published on 01 October 2005

Homogeneous and Heterogeneous Micropore Structures in Carbonaceous Adsorbents—Twenty Years Later ⬇️

artículo científico publicado el 15 de octubre de 2002

How realistic is the pore size distribution calculated from adsorption isotherms if activated carbon is composed of fullerene-like fragments?

artículo científico publicado en 2007

Hydrogen storage in nanoporous carbon materials: myth and facts

scientific article published on 23 March 2007

Hyper-parallel tempering Monte Carlo simulations of Ar adsorption in new models of microporous non-graphitizing activated carbon: effect of microporosity

artículo científico publicado en 2007

Impact of an adsorbed phase nonideality in the calculation of the filling pressure of carbon slit-like micropores

artículo científico publicado en 2004

Impact of the carbon pore size and topology on the equilibrium quantum sieving of hydrogen isotopes at zero coverage and finite pressures ⬇️

artículo científico publicado el 18 de marzo de 2009

Improvement of the Derjaguin-Broekhoff-de Boer theory for capillary condensation/evaporation of nitrogen in mesoporous systems and its implications for pore size analysis of MCM-41 silicas and related materials.

artículo científico publicado en 2005

Improvement of the Derjaguin-Broekhoff-de Boer theory for the capillary condensation/evaporation of nitrogen in spherical cavities and its application for the pore size analysis of silicas with ordered cagelike mesopores.

artículo científico publicado en 2005

Influence of activated carbon surface oxygen functionalities on SO2 physisorption – Simulation and experiment

artículo científico publicado en 2013

Influence of the shape of the layers in photo-cured dental restorations on the shrinkage stress peaks-FEM study

artículo científico publicado en 2009

Intrinsic D 2 /H 2 Selectivity of NaX Zeolite: Interplay between Adsorption and Kinetic Factors

artículo científico publicado en 2015

MD simulation of organics adsorption from aqueous solution in carbon slit-like pores. Foundations of the pore blocking effect.

artículo científico publicado en 2013

Machine learning-assisted design of porous carbons for removing paracetamol from aqueous solutions

scientific article published in 2022

Methane-Induced Deformation of Porous Carbons: From Normal to High-Pressure Operating Conditions

artículo científico publicado en 2012

Microscopic model of carbonaceous nanoporous molecular sieves--anomalous transport in molecularly confined spaces

artículo científico publicado el 5 de agosto de 2010

Modeling of the hysteresis phenomena in finite-sized slitlike nanopores. Revision of the recent results by rigorous numerical analysis

artículo científico publicado en 2005

Molecular dynamics of zigzag single walled carbon nanotube immersion in water

artículo científico publicado en 2011

Molecular insight into the high selectivity of double-walled carbon nanotubes ⬇️

artículo científico publicado el 19 de enero de 2012

Molecular simulation aided nanoporous carbon design for highly efficient low-concentrated formaldehyde capture

artículo científico publicado en 2017

Morphologically disordered pore model for characterization of micro-mesoporous carbons

artículo científico publicado en 2017

Nanoporous quantum filters: inside vapor-liquid transitions of quantum fluids in nanopores

artículo científico publicado en 2010

Nanoscale Insight into the Mechanism of a Highly Oriented Pyrolytic Graphite Edge Surface Wetting by "Interferencing" Water

artículo científico publicado en 2017

Nanoscale Water Contact Angle on Polytetrafluoroethylene Surfaces Characterized by Molecular Dynamics-Atomic Force Microscopy Imaging.

artículo científico publicado en 2018

Nanoscale tubular vessels for storage of methane at ambient temperatures.

artículo científico publicado en 2006

New approach to determination of surface heterogeneity of adsorbents and catalysts from the temperature programmed desorption (TPD) technique: one step beyond the condensation approximation (CA) method

artículo científico publicado en 2005

New findings on the influence of carbon surface curvature on energetics of benzene adsorption from gaseous phase

artículo científico publicado en 2016

New forcefield for water nanodroplet on a graphene surface

artículo científico publicado en 2017

New insights into the ideal adsorbed solution theory

artículo científico publicado en 2015

New relationships between the characteristic energy of adsorption and the average effective diameter of carbon slit-like micropores

artículo científico publicado en 2002

Nuclear Quantum Effects in the Layering and Diffusion of Hydrogen Isotopes in Carbon Nanotubes

artículo científico publicado en 2015

Numerical Analysis of the Horvath–Kawazoe Equation — The Adsorption of Nitrogen, Argon, Benzene, Carbon Tetrachloride and Sulphur Hexafluoride

artículo científico publicado en 2002

Numerical analysis of Horvath-Kawazoe equation.

artículo científico publicado en 2002

Open sensu shaped graphene oxide and modern carbon nanomaterials in translucent hydrophobic and omniphobic surfaces – Insight into wetting mechanisms

Opening the internal structure for transport of ions: improvement of the structural and chemical properties of single-walled carbon nanohorns for supercapacitor electrodes

artículo científico publicado en 2020

Optimal Single-Walled Carbon Nanotube Vessels for Short-Term Reversible Storage of Carbon Dioxide at Ambient Temperatures

artículo científico publicado en 2010

Optimization of Coarse-Grained Interaction Potential: Inside Inherent Limitations of Coarse-Graining Methods ⬇️

artículo científico publicado el 10 de mayo de 2011

Optimization of slitlike carbon nanopores for storage of hythane fuel at ambient temperatures

artículo científico publicado en 2006

Parametric constitutive model of plain-weave fabric reinforced composite ply

journal article; published in Advanced Composite Materials in 2016

Phenol Molecular Sheets Woven by Water Cavities in Hydrophobic Slit Nanospaces

scientific article published on 30 November 2018

Porosity of closed carbon nanotubes compressed using hydraulic pressure

Porous structure of natural and modified clinoptilolites

artículo científico publicado en 2005

Properties of Phenol Confined in Realistic Carbon Micropore Model: Experiment and Simulation

artículo científico publicado en 2015

Quantum fluctuations increase the self-diffusive motion of para-hydrogen in narrow carbon nanotubes ⬇️

artículo científico publicado el 18 de abril de 2011

Role of short-range directional interactions in coarse-graining of protic/aprotic liquids.

artículo científico publicado en 2009

Screening of carbonaceous nanoporous materials for capture of nerve agents

artículo científico publicado en 2012

Separation of CO2-CH4 mixtures on defective single walled carbon nanohorns--tip does matter.

artículo científico publicado en 2013

Simple model of adsorption on external surface of carbon nanotubes—a new analytical approach basing on molecular simulation data

artículo científico publicado en 2010

Simulating the changes in carbon structure during the burn-off process

artículo científico publicado en 2011

Simulation of SF6 adsorption on the bundles of single walled carbon nanotubes

artículo científico publicado en 2012

Some remarks on the calculation of the pore size distribution function of activated carbons.

artículo científico publicado en 2006

Stability of coordination polymers in water: state of the art and towards a methodology for nonporous materials

artículo científico publicado en 2018

State of hydrogen in idealized carbon slitlike nanopores at 77 K

scientific article published on 01 February 2006

Static and thermodynamic properties of low-density supercritical 4He-breakdown of the Feynman-Hibbs approximation.

artículo científico publicado en 2009

Storage of hydrogen at 303 K in graphite slitlike pores from grand canonical Monte Carlo simulation.

artículo científico publicado en 2005

Structural properties of amorphous diamond-like carbon: percolation, cluster, and pair correlation analysis

artículo científico publicado en 2012

Super-sieving effect in phenol adsorption from aqueous solutions on nanoporous carbon beads

artículo científico publicado en 2018

Surface to volume ratio of carbon nanohorn – A crucial factor in CO2/CH4 mixture separation

artículo científico publicado en 2014

Switchable hydrophobicity/hydrophilicity of a HOPG surface - Comment on the paper by Y. Wei and C.Q. Jia, Carbon, 87 (2015) 10-17

artículo científico publicado en 2017

Synergetic effect of carbon nanopore size and surface oxidation on CO2 capture from CO2/CH4 mixtures.

artículo científico

Testing the self-cleaning properties of a coordination polymer surface

artículo científico publicado en 2018

The Application of a CONTIN Package for the Evaluation of Micropore Size Distribution Functions

artículo científico publicado en 2002

The Characterization of Microporous Activated Carbons Utilizing a Simple Adsorption Genetic Algorithm (SAGA).

artículo científico publicado en 2001

The Comparative Analysis of the Properties of Two Micropore-Size Distribution Functions: The Pfeifer–Avnir Function and the Gamma-Type One

artículo científico publicado en 2001

The comparative characterization of structural heterogeneity of mesoporous activated carbon fibers (ACFs)

artículo científico publicado en 2003

The evaluation of the surface heterogeneity of carbon blacks from the lattice density functional theory

artículo científico publicado en 2004

The influence of carbon surface oxygen groups on Dubinin-Astakhov equation parameters calculated from CO2 adsorption isotherm

artículo científico publicado en 2010

The influence of geometric heterogeneity of closed carbon nanotube bundles on benzene adsorption from the gaseous phase-Monte Carlo simulations

The influence of the carbon surface chemical composition on Dubinin-Astakhov equation parameters calculated from SF6 adsorption data-grand canonical Monte Carlo simulation

artículo científico publicado en 2011

The system of carbon tetrachloride and closed carbon nanotubes analyzed by a combination of molecular simulations, analytical modeling, and adsorption calorimetry.

artículo científico publicado en 2010

Thermodynamic properties of benzene adsorbed in activated carbons and multi-walled carbon nanotubes

artículo científico publicado en 2006

Thermodynamics of benzene adsorption on oxidized carbon nanotubes – experimental and simulation studies

artículo científico publicado en 2012

Thermodynamics of hydrogen adsorption in slit-like carbon nanopores at 77 K. Classical versus path-integral Monte Carlo simulations

artículo científico publicado en 2007

Thermodynamics of the CMMS approach and carbon surface chemistry in SO2 adsorption

artículo científico publicado en 2006

To the pore and through the pore: thermodynamics and kinetics of helium in exotic cubic carbon polymorphs

artículo científico publicado en 2013

To what extent can mutual shifting of folded carbonaceous walls in slit-like pores affect their adsorption properties?

artículo científico publicado en 2015

Toward Solving the Unstable Linear Fredholm Equation of the First Kind: A New Procedure Called the Adsorption Stochastic Algorithm (ASA) and Its Properties

artículo científico publicado en 2003

Toward in silico modeling of palladium-hydrogen-carbon nanohorn nanocomposites

scientific article published on 09 May 2014

Toward the Characterization of Microporosity of Carbonaceous Films

artículo científico publicado en 2001

Using in-situ adsorption dilatometry for assessment of micropore size distribution in monolithic carbons

artículo científico publicado en 2016

Virtual Porous Carbons

artículo científico publicado en 2012

Water Adsorption Property of Hierarchically Nanoporous Detonation Nanodiamonds

artículo científico publicado en 2017

Water Nanodroplet on a Hydrocarbon "Carpet"-The Mechanism of Water Contact Angle Stabilization by Airborne Contaminations on Graphene, Au, and PTFE Surfaces

scientific article published on 02 January 2019

Water at Curved Carbon Surface: Mechanisms of Adsorption Revealed by First Calorimetric Study

artículo científico publicado en 2015

Water nanodroplet on a graphene surface-a new old system.

artículo científico publicado en 2016

What kind of pore size distribution is assumed in the Dubinin–Astakhov adsorption isotherm equation?

artículo científico publicado en 2002

Lista de obras de

A Simple Method of the Determination of the Structural Heterogeneity of Microporous Solids

Activated carbon immersed in water-the origin of linear correlation between enthalpy of immersion and oxygen content studied by molecular dynamics simulation

Adsorption energy distribution from the Aranovich-Donohue lattice density functional theory.

Adsorption from aqueous solutions on opened carbon nanotubes--organic compounds speed up delivery of water from inside

Adsorption potential distributions for carbons having defined pore structure—GCMC simulations of the effect of heterogeneity

Adsorption-induced deformation of microporous carbons: pore size distribution effect.

Ammonium sorption from aqueous solutions by the natural zeolite Transcarpathian clinoptilolite studied under dynamic conditions

Applicability of molecular simulations for modelling the adsorption of the greenhouse gas CF4 on carbons.

Ar, CCl(4) and C(6)H(6) adsorption outside and inside of the bundles of multi-walled carbon nanotubes-simulation study.

BET surface area of carbonaceous adsorbents—Verification using geometric considerations and GCMC simulations on virtual porous carbon models

Benzene adsorption on carbonaceous materials: The influence of pore structure on the state of the adsorbate

Bimodal pore size distributions for carbons: experimental results and computational studies.

CO2 - Reinforced nanoporous carbon potential energy field during CO2/CH4 mixture adsorption. A comprehensive volumetric, in-situ IR, and thermodynamic insight

Can carbon surface oxidation shift the pore size distribution curve calculated from Ar, N2and CO2adsorption isotherms? Simulation results for a realistic carbon model ⬇️

Carbon Dioxide Adsorption-Induced Deformation of Microporous Carbons

Carbon Molecular Sieves: Reconstruction of Atomistic Structural Models with Experimental Constraints

Carbon Nanohorns as Reaction Nanochambers - a Systematic Monte Carlo Study

Carbon materials as new nanovehicles in hot-melt drug deposition.

Characterization of Microporous Carbon Materials by Means of a New Gamma-Type Adsorption Isotherm Equation

Constant Pressure Path Integral Gibbs Ensemble Monte Carlo Method.

Cryogenic Helium Adsorbed in Zeolite Rho: Inside Localization Controlled Self-Diffusion of Confined Quantum Particles

Cryogenic Noble Gas Separation without Distillation: The Effect of Carbon Surface Curvature on Adsorptive Separation

Cryogenic separation of hydrogen isotopes in single-walled carbon and boron-nitride nanotubes: insight into the mechanism of equilibrium quantum sieving in quasi-one-dimensional pores

Description of benzene adsorption in slit-like pores. Theoretical foundations of the improved Horvath–Kawazoe method

Detecting adsorption space in carbon nanotubes by benzene uptake

Determination of Isosteric Heat of Adsorption by Quenched Solid Density Functional Theory.

Developing the solution analogue of the Toth adsorption isotherm equation.

Displacement of Methane by Coadsorbed Carbon Dioxide Is Facilitated In Narrow Carbon Nanopores

Distribution of carbon nanotube sizes from adsorption measurements and computer simulation

Effect of the carbon surface layer chemistry on benzene adsorption from the vapor phase and from dilute aqueous solutions

Effects of Critical Fluctuations on Adsorption-Induced Deformation of Microporous Carbons

Efficient adsorption of super greenhouse gas (tetrafluoromethane) in carbon nanotubes.

Elastic properties of cancellous bone derived from finite element models of parameterized microstructure cells

Enhanced geometric model for numerical microstructure analysis of plain-weave fabric-reinforced composite

Equilibrium clusters in concentrated lysozyme protein solutions ⬇️

Estimating the pore size distribution of activated carbons from adsorption data of different adsorbates by various methods

Estimation of the pore-size distribution function from the nitrogen adsorption isotherm. Comparison of density functional theory and the method of Do and co-workers

Evaluation of the Structural and Energetic Heterogeneity of Microporous Carbons by Means of Novel Numerical Methods and Genetic Algorithms

Folding of graphene slit like pore walls--a simple method of improving CO2 separation from mixtures with CH4 or N2

Frequency-Dependent Diffusion Constant of Quantum Fluids from Path Integral Monte Carlo and Tikhonov's Regularizing Functional

Fullerene-Intercalated Graphene Nano-Containers — Mechanism of Argon Adsorption and High-Pressure CH 4 and CO 2 Storage Capacities

Grand Canonical Monte Carlo Simulation Study of Hydrogen Storage in Ordered Mesoporous Carbons at 303 K

Grand canonical monte carlo simulation study of methane adsorption at an open graphite surface and in slit-like carbon pores at 273 K

Heterogeneity on high-resolution alpha(s) plots for carbon nanotubes-GCMC study

Heterogeneous Do-Do model of water adsorption on carbons

Homogeneous and Heterogeneous Micropore Structures in Carbonaceous Adsorbents—Twenty Years Later ⬇️

How realistic is the pore size distribution calculated from adsorption isotherms if activated carbon is composed of fullerene-like fragments?

Hydrogen storage in nanoporous carbon materials: myth and facts

Hyper-parallel tempering Monte Carlo simulations of Ar adsorption in new models of microporous non-graphitizing activated carbon: effect of microporosity

Impact of an adsorbed phase nonideality in the calculation of the filling pressure of carbon slit-like micropores

Impact of the carbon pore size and topology on the equilibrium quantum sieving of hydrogen isotopes at zero coverage and finite pressures ⬇️

Improvement of the Derjaguin-Broekhoff-de Boer theory for capillary condensation/evaporation of nitrogen in mesoporous systems and its implications for pore size analysis of MCM-41 silicas and related materials.

Improvement of the Derjaguin-Broekhoff-de Boer theory for the capillary condensation/evaporation of nitrogen in spherical cavities and its application for the pore size analysis of silicas with ordered cagelike mesopores.

Influence of activated carbon surface oxygen functionalities on SO2 physisorption – Simulation and experiment

Influence of the shape of the layers in photo-cured dental restorations on the shrinkage stress peaks-FEM study

Intrinsic D 2 /H 2 Selectivity of NaX Zeolite: Interplay between Adsorption and Kinetic Factors

MD simulation of organics adsorption from aqueous solution in carbon slit-like pores. Foundations of the pore blocking effect.

Machine learning-assisted design of porous carbons for removing paracetamol from aqueous solutions

Methane-Induced Deformation of Porous Carbons: From Normal to High-Pressure Operating Conditions

Microscopic model of carbonaceous nanoporous molecular sieves--anomalous transport in molecularly confined spaces

Modeling of the hysteresis phenomena in finite-sized slitlike nanopores. Revision of the recent results by rigorous numerical analysis

Molecular dynamics of zigzag single walled carbon nanotube immersion in water

Molecular insight into the high selectivity of double-walled carbon nanotubes ⬇️

Molecular simulation aided nanoporous carbon design for highly efficient low-concentrated formaldehyde capture

Morphologically disordered pore model for characterization of micro-mesoporous carbons

Nanoporous quantum filters: inside vapor-liquid transitions of quantum fluids in nanopores

Nanoscale Insight into the Mechanism of a Highly Oriented Pyrolytic Graphite Edge Surface Wetting by "Interferencing" Water

Nanoscale Water Contact Angle on Polytetrafluoroethylene Surfaces Characterized by Molecular Dynamics-Atomic Force Microscopy Imaging.

Nanoscale tubular vessels for storage of methane at ambient temperatures.

New approach to determination of surface heterogeneity of adsorbents and catalysts from the temperature programmed desorption (TPD) technique: one step beyond the condensation approximation (CA) method

New findings on the influence of carbon surface curvature on energetics of benzene adsorption from gaseous phase

New forcefield for water nanodroplet on a graphene surface

New insights into the ideal adsorbed solution theory

New relationships between the characteristic energy of adsorption and the average effective diameter of carbon slit-like micropores

Nuclear Quantum Effects in the Layering and Diffusion of Hydrogen Isotopes in Carbon Nanotubes

Numerical Analysis of the Horvath–Kawazoe Equation — The Adsorption of Nitrogen, Argon, Benzene, Carbon Tetrachloride and Sulphur Hexafluoride

Numerical analysis of Horvath-Kawazoe equation.

Open sensu shaped graphene oxide and modern carbon nanomaterials in translucent hydrophobic and omniphobic surfaces – Insight into wetting mechanisms

Opening the internal structure for transport of ions: improvement of the structural and chemical properties of single-walled carbon nanohorns for supercapacitor electrodes