3 Articles
Tags :chemistry-software
Chemcraft 2025: Essential Visualization for Computational Chemistry Chemcraft 2025 is a specialized graphical software designed for visualizing and analyzing the results of computational quantum chemistry calculations. It serves as a critical interface for researchers, turning complex numerical output from programs like Gaussian, ORCA, CFOUR, and Molpro into intuitive, interactive 3D models and plots. Core Function: From Data to Visual Insight Its primary role is to import standard calculation output files and visually represent molecular geometries, vibrational modes, molecular orbitals, and electronic spectra, making abstract quantum mechanical data tangible and analyzable. Key Functions: 3D Molecular Visualization: Build, display, and manipulate high-quality 3D models of molecules and complex systems. Orbital & Surface Analysis: Visualize molecular orbitals, electron density, electrostatic potential maps, and...
HSC Chemistry 9.5.1.5: The Foundational Thermodynamic Workbench for Industry HSC Chemistry 9.5.1.5 is a widely respected and comprehensive software package for chemical reaction and equilibrium calculations, serving as a fundamental tool in extractive metallurgy, chemical engineering, and process development. Developed by Outotec, it combines an extensive thermochemical database with robust simulation modules, enabling engineers and researchers to model industrial processes from first principles. By performing heat and mass balances, predicting reaction products, and exploring “what-if” scenarios, HSC Chemistry provides the scientific basis for designing efficient, economical, and sustainable processes in fields like mineral processing, metal production, and environmental engineering. Core Philosophy: Predictive Process Insight Through Fundamental Thermodynamics The power of HSC Chemistry lies in its rigorous application of thermodynamics, primarily...
HSC Chemistry 10.7.0: The Essential Thermodynamic Workbench for Process Industries HSC Chemistry 10.7.0 is the definitive, all-in-one software package for chemical reaction and equilibrium calculations, widely regarded as an indispensable tool in extractive metallurgy, chemical engineering, and process development. Developed by Outotec (now part of Metso Outotec), it combines an extensive thermochemical database with powerful simulation modules, enabling engineers and researchers to model complex chemical processes from first principles. By calculating heat and mass balances, predicting reaction products, and optimizing conditions, HSC Chemistry provides the scientific foundation for designing efficient, sustainable, and economically viable industrial processes. Core Philosophy: Predictive Process Design Through Thermodynamics HSC’s power stems from its rigorous application of thermodynamics. Instead of relying solely on empirical data, users...
