ArticleJournal of chemical information and modeling2020
Brick-CFCMC: Open Source Software for Monte Carlo Simulations of Phase and Reaction Equilibria Using the Continuous Fractional Component Method.
Article in Journal of chemical information and modeling, 2020. The graph could read no effect estimate from its abstract, so it casts no vote on the map. Cited by 20 papers.
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Who cites it
20 citing papers in PubMed.
- Molecular Simulation of Hydrogen Systems: From Properties and Methods to Applications and Future Directions.Chemical reviews · 2025Review
- An Accurate Thermodynamic Model to Characterise Dissociating NInternational journal of thermophysics · 2025Article
- Solubilities and Self-Diffusion Coefficients of LightJournal of chemical and engineering data · 2024Article
- Prediction of Thermochemical Properties of Long-Chain Alkanes Using Linear Regression: Application to Hydroisomerization.The journal of physical chemistry. B · 2024Article
- The Impact of Metal Centers in the M-MOF-74 Series on Formic Acid Production.ACS applied materials & interfaces · 2024Article
- Thermophysical Properties and Phase Behavior of COJournal of chemical and engineering data · 2024Article
- Mutual Diffusivities of Mixtures of Carbon Dioxide and Hydrogen and Their Solubilities in Brine: Insight from Molecular Simulations.Industrial & engineering chemistry research · 2024Article
- Accurate Free Energies of Aqueous Electrolyte Solutions from Molecular Simulations with Non-polarizable Force Fields.The journal of physical chemistry letters · 2024Article
- Interfacial Tensions, Solubilities, and Transport Properties of the HJournal of chemical and engineering data · 2024Article
- Calculating Thermodynamic Factors for Diffusion Using the Continuous Fractional Component Monte Carlo Method.Journal of chemical theory and computation · 2024Article
- Transport Properties of NaCl in Aqueous Solution and Hydrogen Solubility in Brine.The journal of physical chemistry. B · 2023Article
- Solving Chemical Absorption Equilibria using Free Energy and Quantum Chemistry Calculations: Methodology, Limitations, and New Open-Source Software.Journal of chemical theory and computation · 2023Article
- A New Force Field for OHThe journal of physical chemistry. B · 2022Article
- Solubility of COThe journal of physical chemistry. C, Nanomaterials and interfaces · 2022Article
- Solubilities and Transport Properties of COThe journal of physical chemistry. B · 2022Article
- New Features of the Open Source Monte Carlo Software Brick-CFCMC: Thermodynamic Integration and Hybrid Trial Moves.Journal of chemical information and modeling · 2021Article
- Effect of Water Content on Thermodynamic Properties of Compressed Hydrogen.Journal of chemical and engineering data · 2021Article
- Competitive Adsorption of Xylenes at Chemical Equilibrium in Zeolites.The journal of physical chemistry. C, Nanomaterials and interfaces · 2021Article
- In Silico Screening of Zeolites for High-Pressure Hydrogen Drying.ACS applied materials & interfaces · 2021Article
- Solubility of Carbon Dioxide, Hydrogen Sulfide, Methane, and Nitrogen in Monoethylene Glycol; Experiments and Molecular Simulation.Journal of chemical and engineering data · 2021Article
Corrections and comments
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Authors and funding
12 authors.
Funding
No grant is acknowledged in the PubMed record.
Abstract
We present a new molecular simulation code, Brick-CFCMC, for performing Monte Carlo simulations using state-of-the-art simulation techniques. The Continuous Fractional Component (CFC) method is implemented for simulations in the
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Registered trials
Read under generation 80e0d062 · epoch 390. Bibliography from PubMed, PubMed Central and OpenAlex; grants from NIH RePORTER; trial links from ClinicalTrials.gov; estimates, votes and beliefs from the OpenQuestion graph.