Computational Quantum Physics and Chemistry of Nanomaterials

This Special Issue of Nanomaterials collects a series of original research articles providing new insight into the application of computational quantum physics and chemistry in research on nanomaterials. It illustrates the extension and diversity of the field and indicates some future directions. It...

Cur síos iomlán

Sábháilte in:

Sonraí bibleagrafaíochta
Rannpháirtithe:	Šob, Mojmír (Eagarthóir)
Formáid:	Caibidil leabhair
Foilsithe / Cruthaithe:	Basel, Switzerland MDPI - Multidisciplinary Digital Publishing Institute 2021
Ábhair:	Research & information: general BTF TATB CL-20 cocrystal energetic materials shock sensitivity large-scale ab initio molecular dynamics simulations AlN low-dimensional material atomic cluster electronic structure HSE06 hybrid functional CsPbBr3 CsPb2Br5 solvent polarity CTAB phase transition high-entropy alloys generalized stacking fault energy first-principles interfacial energy surface energy nanoparticles gold ab initio molecular mechanics fcc Ni tilt Σ5(210) grain boundary vacancy Si and Al impurity grain boundary energy segregation energy defects binding energies magnetism ferroelectricity SnTe nanoribbon nanoflakes critical size density-functional theory thermodynamics silver decahedron excess energy ab initio calculations dye-sensitized solar cells azobenzene density functional theory topological insulators magnetic doping defects environment and health first-principles physics DFT hazardous gas n/a
Rochtain ar líne:	Get Fullteks DOAB: description of the publication
Clibeanna:	Cuir clib leis Níl clibeanna ann, Bí ar an gcéad duine le clib a chur leis an taifead seo!

Ar líne

Get Fullteks
DOAB: description of the publication

3rd Floor Main Library

Sonraí sealbhúcháin ó 3rd Floor Main Library
Gairmuimhir:	A1234.567
Cóip 1	Ar fáil

Computational Quantum Physics and Chemistry of Nanomaterials

Ar líne

3rd Floor Main Library

Míreanna comhchosúla