Atomic Global Minimum Locator v.1.5.0

This software searches the potential energy surface of small to medium size atomic systems for global minima using quantum ab initio techniques. It performs bond rotations and molecule translations and rotations on a Linux cluster with MPI.

This software searches the potential energy ...

  • Atomic Global Minimum Locator
  • 1.5.0
  • 04 Apr 12
  • atomicglobalmin
  • Linux
  • Freeware
  • 914 Kb
  • 148
  • Free

Review Atomic Global Minimum Locator

  • captcha
New Science software
  • Photovoltaic System  v.5.42Simulate the amortization of a Photovoltaic System over 20..40 years, including Prosumer Electricity Network Trading. Fine-tune as many cost-driving, efficiency, and sales parameters as you want. See Total Amortization, RoI and Net Profit.
  • GHC Timetables EN  v.19.2.37Penalara GHC is an automatic software to generate timetables for schools of different levels: primary schools, high schools, vocational schools, universities and all other academic institutions.
  • CHEMIX School  v.7.00CHEMIX School - Software for Chemistry It is equipped with a periodic table, molecular 3-D viewer, curve fit, spectroscopy, concentration calulator - dilution, and advanced graphic tools and calculators. Chemistry lessons and problems are included.
  • DPLS Scientific Calculator  v.3.2.0This easy to use calculator is a must for science students. It includes triangle calculators, vector calculators, shape calculators, statistical calculators, measurement converters, 3000 compounds, 2000 formulas, 100 constants and 400 symbols.
  • Atomic Backup  v.1.0Parallel and atomic backup utility with web-based management. Written in PHP for simplicity in modifying and extending the framework. Multithreads not-so-multithreaded processes like rdiff-backup, rsync and SSH to decrease backup ...
  • Atomic Linux  v.0.0.1Atomic Linux aims to provide a unique Linux experience by tailoring a system for the individual user, be they a new-comer to Linux or a self-professed Linux guru. The Atomic Linux operating system is designed to deliver this with a tweakable, ...