MCP For Claude Marketplace
Catalyst Performance Evaluator

Catalyst Performance Evaluator MCP Connector for Claude

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Calculates TOF, TON, selectivity, and deactivation rates for heterogeneous catalysis.

4 tools Official Updated Oct 1, 2026 Official Vinkius Partner
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This MCP server provides specialized kinetic calculation tools for evaluating heterogeneous catalyst performance. It allows AI agents to quantify catalytic efficiency by calculating Turnover Frequency (TOF) and Turnover Number (TON) using get_activity_metrics. It also determines product yield efficiency via get_selectivity_profile, quantifies performance decay with get_deactivation_analysis, and identifies physical transport constraints using evaluate_mass_transfer_impact.

catalysiskineticschemistryreaction-engineeringindustrial-science

4 tools expose this connector's capabilities to your AI agent.

get_activity_metrics

Calculates the fundamental efficiency metrics (TOF and TON) of the catalyst

get_deactivation_analysis

Quantifies the loss of catalyst performance over the course of operation

get_selectivity_profile

Determines how effectively the catalyst produces the target molecule

evaluate_mass_transfer_impact

Determines if the observed reaction rate is being hindered by physical transport limitations

See how to talk to your AI agent using Catalyst Performance Evaluator.

Calculate the activity metrics for a reaction with a rate of 0.5 mol/s, 100 active sites, and 10 seconds elapsed.

The turnover frequency (TOF) is 0.005 mol/(site·s) and the turnover number (TON) is 0.05 mol/site.

What is the selectivity if 80g of target product is formed out of 100g of total products?

The selectivity is 0.8 (or 80%).

The initial rate was 1.0 and the current rate is 0.8 after 5 minutes. What is the deactivation rate?

The deactivation rate is 0.04 per minute.

You can use the `get_activity_metrics` tool by providing the reaction rate, the number of active sites, and the time elapsed.

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