Research Datasets (389)

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Simulation data from: The direct synthesis of hydrogen peroxide over Au and Pd nanoparticles: A DFT study. - Willock D, Agarwal N, Thomas L, Nasrallah A, Mala A (2020). Cardiff University. 10.17035/d.2020.0116559060.
Simulation of Mirror Electron Microscopy Caustic Images in Three-Dimensions - Kennedy SM, Jesson DE (2017). Cardiff University. 10.17035/d.2017.0040924851.
Simulation of tidal stream turbines using Hydro3D - Ouro Barba P (2017). Cardiff University. 10.17035/d.2017.0033982819.
Simultaneous neutron powder diffraction and microwave dielectric studies of ammonia absorption in metal–organic framework systems - Barter M, Porch A, Forgan RS, Jones MO (2018). Cardiff University. 10.17035/d.2018.0046822874.
Simultaneous Removal of NOx and Soot Particulate from Diesel Exhaust by In-situ Catalytic Generation and Utilisation of N2O - Davies C, Thompson K, Cooper A, Bogarra Macias M, Doustdar O (2018). Cardiff University. 10.17035/d.2018.0054956978.
Single point energies and statistics for the CRBH20, BHPERI, DARC, ISOMER20, O3ADD6 and CRIEGEE databases - Black JA, Knowles PJ (2017). Cardiff University. 10.17035/d.2017.0038224181.
Smart Water Semantic Model and Latency Results - Howell SK, Rezgui Y, Beach TH (2017). Cardiff University. 10.17035/d.2017.0033337116.
Source and input files to run DOFAS - Ouro, P (2019). Cardiff University. 10.17035/d.2019.0083917166.
Spectroscopic constants for third-row diatomics, calculated with single- and multi-reference methods - Black JA, Knowles PJ (2017). Cardiff University. 10.17035/d.2017.0038224345.
Spectroscopic ellipsometry of nanocrystalline diamond film growth data - Thomas EL, Mandal S, Williams OA, Macdonald JE (2017). Cardiff University. 10.17035/d.2017.0040949318.
Stability and Mobility of Supported Nin (n = 1-10) Clusters on ZrO2(111) and YSZ(111) Surfaces: a Density Functional Theory Study - Cadi-Essadek A, Roldan A, de Leeuw NH (2018). Cardiff University. 10.17035/d.2018.0050609499.
Stable amorphous georgeite as a precursor to a high activity catalyst - Kondrat SA, Hutchings GJ (2016). Cardiff University. 10.17035/d.2015.0008102108.
State estimation of medium voltage distribution networks using smart meter measurements - Al-Wakeel A (2016). Cardiff University. 10.17035/d.2016.0011172323.
Steady state simulation and operation planning of integrated energy supply systems - Abeysekera M, Jenkins N (2017). Cardiff University. 10.17035/d.2017.0031984929.
Steady state wave-field response for aluminium structures of varying thickness - data - Purcell FAF, Pullin R, Eaton M, Pearson MR (2020). Cardiff University. 10.17035/d.2020.0103586142.
Strain Compensated Triple Barrier Resonant Tunnelling Structures for THz Applications - Allford CP, Buckle PD (2017). Cardiff University. 10.17035/d.2017.0031380721.
Structural characterisation and catalytic testing data of shell-core catalysts comprising vanadia-on-haematite - Hellier P, Bowker M, Gianolio D (2017). Cardiff University. 10.17035/d.2017.0042752202.
Structural, energetic, and magnetic properties of cobalt clusters in size range N = 2 - 1500 atoms - Farkas B, de Leeuw NH (2020). Cardiff University. 10.17035/d.2019.0085921605.
Structural study of MFI zeolites nanosheets - Hernandez-Tamargo C, Roldan A, de Leeuw NH (2016). Cardiff University. 10.17035/d.2016.0008216746.
Structure-based design of allosteric calpain-1 inhibitors populating a novel bioactivity space - Kalash L, Cresser-Brown J, Habchi J, Morgan C, Miller DJ, Glen RC, Allemann RK, Bender A (2018). Cardiff University. 10.17035/d.2018.0061359778.
Structure-property-reactivity studies on dithiaphospholes - data - Melen R, Ould D (2019). Cardiff University. 10.17035/d.2019.0084454664.
Structures for cyclic carbonate calculations - Willock DJ, Perrott LT, Hutchings GJ (2017). Cardiff University. 10.17035/d.2017.0038069018.
Study of nano-second laser micro machining of commercially pure titanium - Williams ER, Brousseau EBJ (2016). Cardiff University. 10.17035/d.2015.100113.
Study of NaVOPO4 Polymorphs as Cathode Materials for Na-ion Batteries - Aparicio P A, Dawson J A, Islam M S, de Leeuw N H (2018). Cardiff University. 10.17035/d.2018.0060727953.
Study of Resonance in Wind Parks - Mu Q, Liang J (2015). Cardiff University. 10.17035/d.2015.100104.
Study of the magnetite to maghemite transition using microwave permittivity and permeability measurements - Cuenca JA, Bugler K, Taylor SH, Morgan DJ, Williams PI, Bauer, J, Porch A (2016). Cardiff University. 10.17035/d.2016.0008120528.
Substitutional doping with Ag of the zinc oxide ZnO(0001) surface - dataset - Santos-Carballal D, Cadi-Essadek A, de Leeuw NH (2019). Cardiff University. 10.17035/d.2019.0081497456.
Substitutional doping with Ag of the zinc oxide ZnO(10-10) surfaces - data - Santos Carballal D, Cadi-Essadek A, de Leeuw NH (2020). Cardiff University. 10.17035/d.2019.0081500252.
Substitutional doping with Fe of the zinc oxide ZnO(10-10) surfaces - Santos-Carballal D, Cadi-Essadek A-A, de Leeuw NH (2018). Cardiff University. 10.17035/d.2018.0054411689.
Superconducting boron doped nanocrystalline diamond on boron nitride ceramics - Mandal S, Bland HA, Cuenca JA, Snowball M, Williams OA (2020). Cardiff University. 10.17035/d.2019.0069330616.
Superconducting diamond on silicon nitride for device applications - Bland HA, Thomas ELH, Klemencic GM, Mandal S, Williams OA, Papageorgiou A (2018). Cardiff University. 10.17035/d.2018.0055370965.
Supported Metal Nanoparticles with Tailored Catalytic Properties through Sol immobilisation: Applications for the Hydrogenation of Nitrophenols - Rogers SM, Catlow CRA, Gianolio D, Wells PP, Dimitratos N (2018). Cardiff University. 10.17035/d.2018.0049146792.
Surface Oxidation of Troilite FeS - Terranova U, Mitchell C, Meenakshisundaram S, Morgan DJ, de Leeuw NH (2018). Cardiff University. 10.17035/d.2018.0049771917.
Surface phase metastability during Langmuir evaporation: dataset - Hannikainen K, Gomez D, Pereiro J, Niu YR, Jesson D E (2019). Cardiff University. 10.17035/d.2019.0085857240.
Surface zeta potential and diamond seeding on gallium nitride films - Mandal S, Thomas ELH, Middleton C, Griffiths J (2018). Cardiff University. 10.17035/d.2017.0038570276.
Survey data: definining and measuring communication flexibility for smart logistics - Han JH, Wang Y, Naim MM (2017). Cardiff University. 10.17035/d.2017.0032561022.
Survey data for US and UK on Public risk perceptions of carbon dioxide removal - Cox E, Spence E, Pidgeon N (2020). Cardiff University. 10.17035/d.2020.0101974649.
Switching Chemoselectivity: Using Mechanochemistry to Alter Reaction Kinetics - Browne DL, Howard JL, Brand MC (2018). Cardiff University. 10.17035/d.2018.0062874363.
Synthesis and Reactivity of Fluorinated Triaryl Aluminium Complexes - data - Ould DMC, Carden JL, Melen RL (2020). Cardiff University. 10.17035/d.2020.0114501208.
Synthesis and Reactivity of N-Allenyl Cyanamides - Ayres JN, Williams MTJ, Tizzard GJ, Coles SJ, Ling KB, Morrill LC (2018). Cardiff University. 10.17035/d.2018.0055747356.
Synthesis and reactivity of N,N’-1,4-diazabutadiene derived borocations - Lawson JR, Wilkins LC, André M, Richards EC, Ali MN, Platts JA, Melen RL (2017). Cardiff University. 10.17035/d.2017.0011648832.
Tautomerization of Phenol at the External Lewis Acid Sites of Sc-, Fe- and Ga-substituted Zeolite MFI - Hernandez-Tamargo C, Roldan A, de Leeuw NH (2017). Cardiff University. 10.17035/d.2017.0031746452.
TEM images for Pd-Ru/TiO2 catalysts - Aldosari OF, Iqbal S, Miedziak PJ, Brett GL, Liu X, Edwards JK, Morgan DJ, Knight DK, Hutchings GJ (2016). Cardiff University. 10.17035/d.2015.100119.
Temperature correction for cylindrical cavity perturbation measurements - Cuenca JA, Slocombe D, Porch A (2017). Cardiff University. 10.17035/d.2017.0030964432.
Temperature Correction Using Degenerate Modes for Cylindrical Cavity Perturbation Measurements - dataset - Barter M, Partridge SL, Slocombe DR, Porch A (2018). Cardiff University. 10.17035/d.2018.0050743125.
Test DSET for Outlook junking 13/07/2018 - Bartlett LM (2018). Cardiff University. 10.17035/d.2018.0053450388.
The Controlled Catalytic Oxidation of Furfural to Furoic acid using AuPd/Mg(OH)2 - Douthwaite JM, Huang X, Miedziak PJ (2017). Cardiff University. 10.17035/d.2017.0038854559.
The deposition of metal nanoparticles on carbon surfaces: the role of specific functional groups - Bowden B, Davies M, Davies PR, Guan S, Morgan DJ, Roberts V, Wotton D (2018). Cardiff University. 10.17035/d.2018.0045183226.
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