Post by Software for Chemistry & Materials

𝗔𝗠𝗦𝟮𝟬𝟮𝟱 𝗶𝘀 𝗛𝗲𝗿𝗲 – 𝗙𝗮𝘀𝘁𝗲𝗿, 𝗮𝗻𝗱 𝗠𝗼𝗿𝗲 𝗣𝗼𝘄𝗲𝗿𝗳𝘂𝗹! We’re introducing AMS2025 and BumbleBee 2025, packed with major advancements in OLED Device Modeling & Organic Electronics, more Machine Learning Potentials, and Quantum ESPRESSO integrations. 🌟 𝗪𝗵𝗮𝘁’𝘀 𝗡𝗲𝘄? 🔹 Bumblebee 2025 – Go beyond 1D Drift-Diffusion for OLED device modeling 🔹 Multiscale OLED Workflow – Now significantly faster with AMS 🔹 New Machine Learning Potentials – Run CHGNet, FairChem, MACE, MatterSim, ORB, and many more via AMS 🔹 Upgraded GUI – Faster startup, JuPyter support and much improved Packmol interface 🔹 Quantum ESPRESSO Enhancements – IR, Raman, Work function, and Phonons for crystals 🔹 COSMO-SAC DHB-MESP – Improved prediction of fluid thermodynamic properties for associating fluids 🔹 All-around Improvements – Performance, stability, and usability refinements With AMS2025, researchers and engineers have the tools to push the boundaries of materials science and computational chemistry. https://lnkd.in/erabjGU9 💡 𝗘𝘅𝗽𝗹𝗼𝗿𝗲 𝘄𝗵𝗮𝘁’𝘀 𝗽𝗼𝘀𝘀𝗶𝗯𝗹𝗲 𝘄𝗶𝘁𝗵 𝗔𝗠𝗦𝟮𝟬𝟮𝟱 𝘁𝗼𝗱𝗮𝘆! #computationalchemistry #compchem #materialsscience #materials #oled #display #simulation