Research focus
QuantumSIMM presents exciting opportunities to tackle complex problems, foster innovation, and make groundbreaking discoveries by working in different disciplines, such as condensed matter physics, computational chemistry, mass spectrometry, food & flavor analysis, reaction kinetics, and materials.
Mass Spectrometry
We study ion Chemistry, ion-molecule reactions, molecular reactivity useful in CIMS by using quantum chemical calculations.
Food & Flavor
Research in food and flavor focuses on understanding the chemical composition, sensory perception, and physiological effects of flavors on foods.
Materials
We employ popular electronic structure methods to simulate materials for chemical and physical properties of materials to better understand them.
Catalysts
We are particularly interested in applying DFT to understand reaction mechanisms, physical and chemical processes taking place at the surfaces, reaction barriers.
Computational Chemistry
To find geometrical structure, electronic properties, vibrational properties, spectroscopy, thermochemistry, along with many other reaction mechanisms.
Gas Sensor
We explore the phenomenon of gas adsorption on molecular surfaces, various types of interactions involved, adsorption energy, and conductivity in gas sensing.
Everything you need for computational chemistry research
From collaboration tools to educational resources, QuantumSIMM provides a complete platform for advancing your research and connecting with the global scientific community.
Our Collaborators
Discover Quantumsimm’s Expertise
Benefit from the insights of our seasoned researchers. Explore our extensive collection of peer-reviewed publications. Learn about our cutting-edge projects in progress. Gain a glimpse into our exciting research directions. Explore potential funding sources and collaborations. Discover additional resources and information tailored to your needs.
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Join thousands of researchers who are already using QuantumSIMM to collaborate, publish, and advance computational chemistry.
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Collaborate to create a dynamic environment where creativity thrives, where insightful discussions spark novel perspectives, and where intellectual collisions ignite transformative insights