• PRIMME

  • Referenced in 44 articles [sw04023]
  • thus computational demands to unprecedented levels. Materials science, structural engineering, and some QCD applications routinely...
  • FiPy

  • Referenced in 19 articles [sw10791]
  • framework has been developed in the Materials Science and Engineering Division (MSED) and Center ... Theoretical and Computational Materials Science (CTCMS), in the Material Measurement Laboratory (MML) at the National ... ubiquitous to the numerical simulation of science problems. Numerous PDE solvers exist, using a variety...
  • LEDA

  • Referenced in 261 articles [sw00509]
  • core computer science areas -- data structures, graph and network algorithms, and computational geometry -- LEDA ... first library to cover all material found in the standard textbooks. Written...
  • TREMOLO-X

  • Referenced in 5 articles [sw20332]
  • modeling of systems in the areas material science, nanotechnology and biophysics. TREMOLO-X includes also ... focus is on computations in nanotechnology, material science, biochemistry and biophysics...
  • Avogadro

  • Referenced in 6 articles [sw15099]
  • computational chemistry, molecular modeling, bioinformatics, materials science, and related areas. It offers flexible high quality...
  • Graphs

  • Referenced in 104 articles [sw12277]
  • areas such as transportation, networking, and social science, this problem has been considered by researchers ... methods; database and information systems researchers investigate materialization tradeoffs, query processing on spatial networks...
  • GiD

  • Referenced in 54 articles [sw07799]
  • analysis of any problem in science and engineering using numerical methods: structured, unstructured or particle ... based meshes, boundary and loading conditions, material types, visualization of numerical results, etc. Adaptive...
  • KIMA

  • Referenced in 3 articles [sw13347]
  • measurement conflicts: A case-study in materials science. Resolving conflicts between different measurements ... applied in a case-study in materials science. In order to be a useful...
  • GPAW

  • Referenced in 4 articles [sw22161]
  • widely used tool in materials science and large consumer of supercomputing resources. Traditionally, the software...
  • CONQUEST

  • Referenced in 4 articles [sw02551]
  • fields such as physics, chemistry, materials science and biochemistry, it has long been recognised that...
  • Atomate

  • Referenced in 2 articles [sw32763]
  • generate, execute, and analyze computational materials science workflows. We introduce atomate, an open-source Python ... framework for computational materials science simulation, analysis, and design with an emphasis on automation ... Python packages already in use by the materials community such as pymatgen, FireWorks, and custodian ... that enable one to compose complex materials science workflows that use a diverse...
  • Avizo

  • Referenced in 2 articles [sw18539]
  • need to be processed, in life sciences, materials science, natural sciences or industrial inspection applications...
  • OOF3D

  • Referenced in 3 articles [sw25448]
  • image-based finite element solver for materials science. OOF3D is just like OOF2...
  • FireWorks

  • Referenced in 3 articles [sw28739]
  • hours worth of computational chemistry and materials science calculations at the National Energy Research Supercomputing...
  • ELSI

  • Referenced in 3 articles [sw29868]
  • solutions for electronic structure calculations in materials science, condensed matter physics, chemistry, molecular biochemistry...
  • Parsl

  • Referenced in 3 articles [sw28682]
  • fields such as biology, cosmology, and materials science...
  • MateriApps LIVE

  • Referenced in 1 article [sw22112]
  • high-precision application software for computational materials science simulation have been developed in Japan ... developing MateriApps, a portal site of materials science simulation, aiming at introducing the features ... characteristics of various materials science simulation programs that have not been known widely or that...
  • Materials Studio

  • Referenced in 2 articles [sw14417]
  • environment designed to allow researchers in materials science and chemistry to predict and understand...
  • PANDAT

  • Referenced in 2 articles [sw27262]
  • broader applications in the field of Materials Science and Engineering...
  • MUESLI

  • Referenced in 2 articles [sw32519]
  • Materials, it is available to the material science and computational mechanics community as a suite...