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[MedeA] MedeA 3.9 Release note

작성자 관리자 날짜 2024-05-30 11:24:40 조회수 134

MedeA 3.9 버전의 Release Note 입니다.

최신 MedeA 프로그램의 업데이트 내역을 확인 하실 수 있습니다.

 

MedeA 3.9 introduces a range of ground-breaking new features. Highlights include: 

 

  • Machine-Learned Atomic Cluster Expansion (ACE) Potentials based on the PACEMAKER code,  
  • Enhanced VASP Quantum Engine  with new density functionals and Projector Augmented Wave (PAW) potentials, designed for performance on the latest graphics processors, 
  • Improved atomistic forcefields enhancing the accuracy of simulations and their applicability in diverse research areas, and 

Innovative VOTCA module for seamless parameterization of coarse-grained forcefields from atomistic simulations for mesoscale applications.  

 

관련링크: Software Releases | Materials Design Inc

 

감사합니다.

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