| 000 | 01286nam a2200121Ia 4500 | ||
|---|---|---|---|
| 008 | 220615s9999||||xx |||||||||||||| ||und|| | ||
| 245 | 0 | _aComputational Quantum Physics and Chemistry of Nanomaterials | |
| 546 | _aEnglish[eng] | ||
| 650 | _aBTF||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 | ||
| 700 | _aÅ ob, MojmÃr | ||
| 856 | _uhttps://mdpi.com/books/pdfview/book/3557 | ||
| 942 | _cEB | ||
| 999 |
_c11426 _d11426 |
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