| Foreword XI Acknowledgements XII PL-1 One and Two-Dimensional Solid-Slate NMR Investigations of the Three-Diraensional Structures of Zeolite-Organic Sorbate Complexes |
Submitted |
| When simple systems do complex things |
Submitted |
| Keynote–Tailoring support for the net generation: an insight into students‟ real use and experience of using technologies |
Submitted |
| SGC4L Briefing Paper |
Submitted |
| Faculty and students as collaborators, co-creators, and makers |
2017 |
| Faculty Perceptions of Challenges and Enablers of Effective Teaching in a Large Research-Intensive University: Preliminary Findings |
2016 |
| Plenary: Faculty and students as collaborators, co-creators and makers |
2015 |
| Assessing the quality of a student-generated question repository |
2014 |
| Scaffolding student engagement via online peer learning |
2014 |
| Fostering Learning Improvements in Physics |
2014 |
| What response rates are needed to make reliable inferences from student evaluations of teaching? |
2014 |
| Student-generated content: Enhancing learning through sharing multiple-choice questions |
2014 |
| Gender differences in conceptual understanding of Newtonian mechanics: a UK cross-institution comparison |
2013 |
| Student-generated assessment |
2013 |
| The effect of research-based instruction in introductory physics on a common cognitive bias |
2013 |
| PeerWise: student-generated content for enhanced engagement and learning |
2013 |
| The inverted classroom in a large enrolment introductory physics course : a case study. |
2013 |
| Fostering Learning Improvements in Physics (FLIP): A status report |
2013 |
| Different perspective, same challenges |
2013 |
| SGC4L Final Evaluation Report |
2013 |
| Student-generated content: Using PeerWise to enhance engagement and outcomes in introductory physics courses |
2012 |
| Gender differences in conceptual understanding of Newtonian mechanics: a UK cross-institution comparison |
2012 |
| Reshaping large-class undergraduate science courses: the weekly workshop |
2012 |
| The high-pressure electronic structure of the [Ni (ptdt) 2] organic molecular conductor |
2012 |
| A longitudinal study of the development of attitudes and beliefs towards physics |
2012 |
| The inverted classroom in a large enrolment introductory physics course: a case study. |
2012 |
| Student-Generated Content for Learning (SGC4L): Enhancing Engagement, Feedback and Performance |
2012 |
| The changes in attitudes and beliefs of first year physics undergraduates: A study using the CLASS survey |
2011 |
| How attitudes and beliefs about physics change from high school to faculty |
2011 |
| Student-generated content: using PeerWise to enhance engagement and outcomes in introductory physics courses |
2011 |
| The changes in attitudes and beliefs of first year physics undergraduates: A study using the CLASS survey. |
2011 |
| OPEN BUSINESS |
2011 |
| Diagnostic tests for the physical sciences: A brief review |
2010 |
| ATTITUDES TOWARDS SCIENCE STUDY: CLASS AT THE UNIVERSITY OF EDINBURGH |
2010 |
| Structure and bonding of aqueous glutamic acid from classical molecular dynamics simulations |
2010 |
| Closing the feedback loop for clicker questions |
2010 |
| Mapping the transition: Content and pedagogy across the school-university boundary |
2009 |
| Asking the right questions: Developing diagnostic tests in undergraduate physics |
2009 |
| First principles determination of structural, electronic and lattice dynamical properties of a model dipeptide molecular crystal |
2009 |
| Pressure-Induced Metallization of a Single-Component Molecular Crystal |
2009 |
| Peptide aggregation and solvent electrostriction in a simple zwitterionic dipeptide via molecular dynamics simulations |
2009 |
| ICT & the Student First Year Experience |
2009 |
| Techniques for Gathering Student Views of their Experiences at University |
2009 |
| Research-teaching linkages: enhancing graduate attributes. Physical sciences |
2008 |
| Recent Issues |
2008 |
| Expectations and Reality: Exploring the use of learning technologies across the disciplines |
2008 |
| Tracking and Visualisation of Student Use of Online Learning Materials in a Large Undergraduate Course |
2008 |
| How design of online learning materials can accommodate the heterogeneity in student abilities, aptitudes and aspirations |
2008 |
| Assessing the impact and potential of podcasts as pre-lectures |
2007 |
| How Design of Online Learning Materials can Accommodate the Heterogeneity in Student Abilities, Aptitudes and Aspirations |
2007 |
| Tracking and visualisation of student use of online learning materials in a large undergraduate course |
2007 |
| Collaborative Problem-Solving In First Year Physics |
2007 |
| DUMP: A Database of Useful MCQs for Physics |
2007 |
| Structure and hydrogen bonding in neat N-methylacetamide: Classical molecular dynamics and Raman spectroscopy studies of a liquid of peptidic fragments |
2006 |
| Technical aspects of developing web-based Mathsaware assessment systems |
2006 |
| The modus operandi of the next generation e-learner; an analysis of tracking usage across the disciplines |
2006 |
| The use of electronic voting systems in large group lectures: challenges and opportunities |
2006 |
| Solution structure of the aqueous model peptide N-methylacetamide |
2006 |
| Structure and dynamics of water in aqueous methanol |
2005 |
| Liquid NMA: A surprisingly realistic model for hydrogen bonding motifs in proteins |
2005 |
| Integrating e-learning and on campus teaching I: an overview |
2005 |
| Integrating e-learning and on-campus teaching II: evaluation of student use |
2005 |
| Adsorption and structure of hydrocarbons in MCM-41: a computational study |
2005 |
| Segregation in aqueous methanol enhanced by cooling and compression |
2005 |
| The Aqueous Environment: Lessons from Small Molecules |
2005 |
| Clustering and microimmiscibility in alcohol-water mixtures: Evidence from molecular-dynamics simulations |
2005 |
| Inhomogeneous, disordered, and partially ordered systems-Clustering and microimmiscibility in alcohol-water mixtures: Evidence from molecular-dynamics simulations |
2005 |
| Simulating the structure and reactivity of oxide surfaces from first principles |
2004 |
| Simulating the adsorption of binary and ternary mixtures of linear, branched, and cyclic alkanes in zeolites |
2004 |
| Methanol-water solutions: A bi-percolating liquid mixture |
2004 |
| Simulating the adsorption of linear, branched and cyclic alkanes in silicalite-1 and AlPO4-5 |
2004 |
| A molecular orbital study of the conformational properties of tyramine and phenethylamine |
2004 |
| e-learner tracking: Tools for discovering learner behavior |
2004 |
| Comparison of experimental and calculated 1H NMR chemical shifts of geometric photoisomers of azo dyes |
2003 |
| Assignment of the (1$\times$ 2) surface of rutile TiO\_ $\{$2$\}$(110) from first principles |
2003 |
| The novel use of NMR spectroscopy with in situ laser irradiation to study azo photoisomerisation |
2003 |
| Assignment of the (1$\times$ 2) surface of rutile TiO 2 (110) from first principles |
2003 |
| The nature of conformational preference in a number of p-alkyl phenols and p-alkyl benzenes |
2002 |
| Full-coverage adsorption of water on SnO2 (1 1 0): the stabilisation of the molecular species |
2002 |
| Assigning the (1$\times$ 2) surface reconstruction on reduced rutile by first-principles energetics |
2002 |
| A first principles survey of stoichiometric (1$\times$ 2) reconstructions on the rutile surface |
2001 |
| Energetically accessible reconstructions along interstitial rows onthe rutile (110) surface |
2001 |
| Structure and properties of isolated liquid crystal molecules: jet spectroscopy and ab initio calculations of 4-cyanobiphenyl |
2000 |
| Risks of thrombophilia and diagnostics of pulmonary embolism |
2000 |
| Calculations of the electronic structure of substituted indoles and prediction of their oxidation potentials |
2000 |
| Abinitio study of single and double point adsorption of carbon monoxide on clusters representing zeolites |
1999 |
| ChemInform Abstract: The Molecular Basis of Zeolite Catalysis: A Review of Theoretical Simulations |
1998 |
| The adsorption and dissociation of ROH molecules on TiO< sub> 2</sub>(110) |
1998 |
| ChemInform Abstract: Broensted Acidity in Zeolites |
1998 |
| Adsorption of methanol on TiO2 (110): A first-principles investigation |
1998 |
| The adsorption and dissociation of ROH molecules on TiO 2 (110) |
1998 |
| The molecular basis of zeolite catalysis: a review of theoretical simulations |
1998 |
| Molecular processes on oxide surfaces studied by first-principles calculations |
1998 |
| Intrinsic and enhanced broensted acidity in zeolites |
1997 |
| The chemical nature of atomic oxygen adsorbed on Rh (111) and Pt (111): A density functional study |
1997 |
| Broensted acidity in zeolites |
1997 |
| Configurational-Bias Monte Carlo (CB-MC) calculations of n-alkane sorption in zeolites RHO and FER |
1997 |
| A systematic study of the surface energetics and structure of TiO< sub> 2</sub>(110) by first-principles calculations |
1997 |
| Computational study of zeolitic-proton [ndash] palladium chemistry |
1997 |
| Ab initio simulation of molecular processes on oxide surfaces |
1997 |
| ELSEVIER Surface Science 385 (1997) 403406 |
1997 |
| A systematic study of the surface energetics and structure of TiO 2 (110) by first-principles calculations |
1997 |
| Location and conformation of n-alkanes in zeolites: an analysis of configurational-bias Monte Carlo calculations |
1996 |
| Energetics of n-alkanes in zeolites: a configurational-bias Monte Carlo investigation into pore size dependence |
1996 |
| Team |
1995 |
| Brønsted sites of enhanced acidity in zeolites: experimental modelling |
1995 |
| In Situ Modeling of the Enhanced Broensted Acidity in Zeolites |
1995 |
| Ab initio study of methanol sorption and proton transfer on a zeolite acid site model |
1995 |
| Broensted sites of enhanced acidity in zeolites: experimental modelling |
1995 |
| Improvements in ab initio calculated OH stretching frequencies of zeolite acid site models and other OH-containing molecules, using a Morse potential |
1994 |
| Ab initio study of methanol sorption and proton transfer on a zeolite acid site model |
1994 |
| Ab initio study of a Brønsted acid site model and complex with CO, with and without symmetry constraints |
1994 |
| Quantum Chemical Calculations of Zeolite Acid-site Models and Their Complexes with Bases |
1994 |
| Ab initio study of carbon monoxide adsorption on zeolites |
1993 |
| Taking the lead: learners’ experiences across the disciplines |
2009 |
| teaching linkages: enhancing graduate attributes. Physical sciences |
2008 |
| An Evaluation of an e-Learning Strategy: Watching the e-Learners Learn |
2004 |
| Interactive physics: a virtual library of simulations for use in physics undergraduate teaching |
2003 |