Molecular Dynamics Investigation of the Impact of Methylation on the Nematic Phase of Phenyl Benzoate Mesogens and Dimers

Key Points

• The aim is to explore how methylation influences the nematic phase in liquid crystal materials.
• Conduct molecular dynamics simulations of phenyl benzoate mesogens and dimers
• Analyze the effects of methylation on phase behavior
• Evaluate mechanical and optical properties of liquid crystals
• Methylation alters the stability and characteristics of the nematic phase
• Enhanced optical and mechanical properties observed in modified mesogens
• Findings indicate potential improvements in liquid crystal applications