Sökning: "total-energy"
Visar resultat 1 - 5 av 201 avhandlingar innehållade ordet total-energy.
1. Total-energy calculations with the effective-medium theory
Sammanfattning : .... LÄS MER
2. Total Energy Calculations for Predictive Modeling of Crystalline Materials Strength
Sammanfattning : Materials properties depend on phenomena in a hierarchical order from atomic to macroscopic scales. This thesis studies possibilities for electron-structure and total-energy calculations to provide results that are valuable for the modeling of crystalline materials strength. LÄS MER
3. Interatomic total-energy potentials for atomistic simulations of metallic systems
Sammanfattning : .... LÄS MER
4. Interactions of molecules and solids within the density-functional theory
Sammanfattning : .... LÄS MER
5. Aspects of nutrition in geriatric patients - Especially dietary assessment, intake and requirements
Sammanfattning : The aim of this thesis was to develop and test the feasibility of a dietary record routine, where nursing staff assess the patient’s food and fluid intake based on standardised portion sizes and household measurements. The energy intake (EI) was studied with a dietary record in 61 geriatric patients. LÄS MER