Results 101 to 110 of about 308,241 (259)

Machine Learning Accelerated Computational Design of Bio‐Inspired Catalysts in the Nitrogen Reduction Reaction

open access: yesAdvanced Materials, EarlyView.
We introduce a computational workflow that combines quantum chemical calculations and machine learning techniques to predict the catalytic performance of a wide range of catalysts in the nitrogen reduction reaction (NRR). The analysis of the trained models provides insights into the complex structure–activity relationship in experimental catalytic ...
Leonardo Di Ciano   +5 more
wiley   +1 more source

Choosing Grounded Theory

open access: yes, 2014
This book deals simply with choosing classic grounded theory (CGT) as the methodology to use mainly for doing the dissertation. CGT stands alone as a separate method, not as a competitive method in conflict and controversy with all the QDA (qualitative ...
Barney G. Glaser, PhD, Hon. PhD
core  

Ferroelectric Dynamic‐Field‐Driven Nucleation and Growth Model for Predictive Materials‐To‐Circuit Co‐Design

open access: yesAdvanced Materials, EarlyView.
This study presents a compact dynamic‐field‐driven nucleation and growth (DFNG) model that captures ferroelectric switching behavior under arbitrary voltage waveforms. It enables extraction of time‐dependent domain wall velocity and growth dimensionality, which can then be extended to device‐level modeling.
Yi Liang   +10 more
wiley   +1 more source

Layered Nanoporous Platforms for SERS Sensing

open access: yesAdvanced Materials Interfaces, EarlyView.
Here, we present a detailed investigation of the SERS performance of layered nanoporous metals. The controlled deposition of well‐defined, stacked porous layers enabled a systematic analysis of the effects of multimetallic systems in SERS experiments. Numerical models are also used to support the experimental findings.
Yanqiu Zou   +18 more
wiley   +1 more source

The Grounded Theory Bookshelf

open access: yes, 2005
The Grounded Theory Perspective III: Theoretical Coding, Barney G. Glaser (Sociology Press, 2005). Not intended for a beginner, this book further defi nes, describes, and explicates the classic grounded theory (GT) method.
Dr. Alvita Nathaniel, DSN, APRN, BC
core  

A Survey of Interlayer Interaction Models for Graphene and Other 2D Materials

open access: yesAdvanced Materials Interfaces, EarlyView.
Van der Waals interactions arising from electronic polarization at atomically close interfaces generate corrugated interlayer energy landscapes that govern normal and tangential tractions. This review presents an overview of quantum, atomistic, analytical, and continuum modeling approaches, highlighting their roles across length scales in capturing ...
Gourav Yadav   +2 more
wiley   +1 more source

Being person driven in a service driven organisation: a grounded theory of revisioning service ideals and client realities

open access: yes, 2010
This paper presents the theory of ‘Revisioning Service Ideals and Client Realities’, which emerged from a classic grounded theory study of health care practitioners working within Condition Management Programmes.
Breckenridge, Jenna
core  

Interface‐Engineered Binary Framework Composites: Advancing Porous Materials for Precision Medicine

open access: yesAdvanced Materials Interfaces, EarlyView.
Binary framework composites integrate two complementary porous architectures into a unified platform, enabling multifunctional design, enhanced structural tunability, and improved physicochemical performance. By combining high surface area, ordered porosity, interfacial synergy, and versatile functionalization, these hybrid materials offer new ...
Navid Rabiee   +3 more
wiley   +1 more source

Becoming Selfless: A Grounded Theory of Commitment to Service

open access: yes, 2014
This study focuses on the substantive area of commitment to service in the community of educational partners in the Philippines. Educational partners are lay people who assist religious organizations in the field of education, and in the Philippines ...
Roland Nino L. Agoncillo   +1 more
core  

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