国家/地区 Spain（14）
关键词 MOLECULAR DYNAMIC（14）
出版物 JOURNAL OF MOLECULA.（2） NANOMATERIALS（2） NUCLEAR INSTRUMENTS.（2）
出版时间 2017（3） 2010（2） 2021（2） 2023（2）
机构 UNIV ALICANT.（2） UNIV AUTONOM.（2）
作者 CALERO C（2） CATURLA MJ（2） CUESTA IG（2） DE MERAS AS（2）
FAGINASLAGO .（2） FRANZESE G（2） MARTINEZASEN.（2） PEREZ R（2）
SANCHEZMARIN.（2） SERENA PA（2） VILHENA JG（2）

Water under extreme confinement in graphene: Oscillatory dynamics, structure, and hydration pressure explained as a function of the confinement width

JOURNAL OF MOLECULAR LIQUIDS

CALERO C, FRANZESE G

Modeling the Interaction of Carbon Monoxide with Flexible Graphene: From Coupled Cluster Calculations to Molecular-Dynamics Simulations

CHEMPHYSCHEM

WILSON J, FAGINASLAGO N, VEKEMAN J, CUESTA IG, SANCHEZMARIN J, DE MERAS AS

Long-term dynamic stability of discrete dislocations in graphene at finite temperature

INTERNATIONAL JOURNAL OF FRACTURE

ARIZA MP, ORTIZ M, SERRANO R

Molecular dynamics simulations of water confined in graphene nanochannels: From ambient to supercritical environments

JOURNAL OF MOLECULAR LIQUIDS

MARTI J, SALA J, GUARDIA E

Modelization of the H-2 adsorption on graphene and molecular dynamics simulation

THEORETICAL CHEMISTRY ACCOUNTS

FAGINASLAGO N, BIN YEAMIN M, SANCHEZMARIN J, CUESTA IG, ALBERTI M, DE MERAS AS

Tailoring the thermal expansion of graphene via controlled defect creation

CARBON

LOPEZPOLIN G, ORTEGA M, VILHENA JG, ALDA I, GOMEZHERRERO J, SERENA PA, GOMEZNAVARRO C, PEREZ R

Defect production in Ar irradiated graphene membranes under different initial applied strains

NUCLEAR INSTRUMENTS METHODS IN PHYSICS RESEARCH SECTION BBEAM INTERACTIONS WITH MATERIALS ATOMS

MARTINEZASENCIO J, RUESTES CJ, BRINGA E, CATURLA MJ

Atomic-Scale Sliding Friction on Graphene in Water

ACS NANO

VILHENA JG, PIMENTEL C, PEDRAZ P, LUO F, SERENA PA, PINA CM, GNECCO E, PEREZ R

Molecular dynamics simulations of defect production in graphene by carbon irradiation

NUCLEAR INSTRUMENTS METHODS IN PHYSICS RESEARCH SECTION BBEAM INTERACTIONS WITH MATERIALS ATOMS

MARTINEZASENCIO J, CATURLA MJ

Hydrogen dynamics on defective monolayer graphene

CHEMICAL PHYSICS

HERRERO CP, VERGES JA, RAMIREZ R