For the scientific journal, see Computational Materials Science (journal).
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Computational materials science and engineering uses modeling, simulation, theory, and informatics to understand materials. The main goals include discovering new materials, determining material behavior and mechanisms, explaining experiments, and exploring materials theories. It is analogous to computational chemistry and computational biology as an increasingly important subfield of materials science.
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sub-field of computationalmaterialsscience is integrated computationalmaterials engineering (ICME), which seeks to use computational results and methods...
Materialsscience is an interdisciplinary field of researching and discovering materials. Materials engineering is an engineering field of finding uses...
Computationalscience, also known as scientific computing, technical computing or scientific computation (SC), is a division of science that uses advanced...
Integrated ComputationalMaterials Engineering (ICME) is an approach to design products, the materials that comprise them, and their associated materials processing...
Computational Engineering is an emerging discipline that deals with the development and application of computational models for engineering, known as Computational...
enabled by using computational methods. It is the area of computationalscience (or scientific computing) specific to the mathematical science of statistics...
Annual Review of Materials Research APL Materials Bulletin of MaterialsScience Carbon Chemistry of MaterialsComputationalMaterialsScience Crystal Growth...
Computational thinking (CT) refers to the thought processes involved in formulating problems so their solutions can be represented as computational steps...
Computational thermodynamics is the use of computers to simulate thermodynamic problems specific to materialsscience, particularly used in the construction...
"The AFLOW Library of Crystallographic Prototypes: Part 2". ComputationalMaterialsScience. 161: S1-S1011. arXiv:1806.07864. doi:10.1016/j.commatsci.2018...
dynamics simulations in computational chemistry, computational physics and computationalmaterialsscience to explain and predict materials properties. Examples...
Progress in Optics ComputationalMaterialsScience Computer Physics Communications International Journal of Modern Physics C (computational physics, physical...
Clarkson University in 1987. He has contributed to research in computationalmaterialsscience, particularly on Marangoni Effect in solidification processes...
Advancement of Science (AAAS) and the American Physical Society (APS). She has served as editor-in-chief of the journal ComputationalMaterialsScience since 2014...
the MaterialsSciences Division of Lawrence Berkeley National Laboratory. He is notable for his pioneering research in high-throughput computational materials...
development, and discovery of materials. The term "materials informatics" is frequently used interchangeably with "data science", "machine learning", and...
Computational physics is the study and implementation of numerical analysis to solve problems in physics. Historically, computational physics was the...
described as a material's amenability to drawing (e.g. into wire). In materialsscience, ductility is defined by the degree to which a material can sustain...
is no clear division in computing between science and engineering, just like in the field of materialsscience and engineering. However, some classes are...
recognized for her significant contributions in the field of computationalmaterialsscience, particularly in its applications to catalysis, charge transport...
constituent materials. These constituent materials have notably dissimilar chemical or physical properties and are merged to create a material with properties...
crystalline and amorphous materials. These strengthening mechanisms give engineers the ability to tailor the mechanical properties of materials to suit a variety...
27, 1989) is an American physicist and computationalmaterial scientist. She is a Professor of Physical Sciences and Howard Reiss Chair at the University...
and design of nanoscale materials. It is co-located with Spallation Neutron Source. The Center for Nanophase MaterialsSciences (CNMS) at Oak Ridge National...