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Collection's Items (Sorted by Title in Ascending order): 21 to 40 of 1143
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Publication DateTitleAuthor(s)
1-Nov-2009A Coherent Mechanistic Rationale for Additive Effects and Autoinductive Behaviour in Proline-Mediated ReactionsZotova, N; Moran, A; Armstrong, A; Blackmond, DG
13-Jun-2017A colorimetric method for rapid and selective quantification of peroxodisulfate, peroxomonosulfate and hydrogen peroxideDeadman, BJ; Hellgardt, K; Hii, KM
21-Jun-2016A combined thermodynamics and first principles study of the electronic, lattice and magnetic contributions to the magnetocaloric effect in La0.75Ca0.25MnO3Korotana, RK; Mallia, G; Fortunato, NM; Amaral, JS; Gercsi, Z, et al
4-Jan-2017A combined X-ray scattering and simulation study of halothane in membranes at raised pressuresMcCarthy, NL; Brooks, NJ; Tyler, AII; ElGamacy, M; Welche, P, et al
3-Aug-2016A comprehensive scenario of the thermodynamic anomalies of water using the TIP4P/2005 modelGonzález, MA; Valeriani, C; Caupin, F; Abascal, JLF
21-Mar-2017A computational approach to calculate the heat of transport of aqueous solutionsDi Lecce, S; Albrecht, T; Bresme, F
5-Jan-2018A computational exploration of the crystal energy and charge-carrier mobility landscapes of the chiral [6]helicene moleculeRice, B; LeBlanc, LM; Otero-de-la-Roza, A; Fuchter, MJ; Johnson, ER, et al
21-Jul-2015A computer simulation approach to quantify the true area and true area compressibility modulus of biological membranesChacon, E; Tarazona, P; Bresme, F
4-Mar-2008A defective graphene phase predicted to be a room temperature ferromagnetic semiconductorPisani, L; Montanari, B; Harrison, NM
29-Jan-2018A Definition of the Magnetic Transition Temperature Using Valence Bond Theory.Jornet-Somoza, J; Deumal, M; Borge, J; Robb, MA
10-Oct-2016A DFT mechanistic study on ethylene tri- and tetramerization with Cr/PNP catalysts: single versus double insertion pathwaysBritovsek, GJ; McGuinness, DS
1-Feb-2012A fluorescence-based assay for N-myristoyltransferase activityGoncalves, V; Brannigan, JA; Thinon, E; Olaleye, TO; Serwa, R, et al
25-Nov-2010A global picture of the S-1/S-0 conical intersection seam of benzeneLi, Q; Mendive-Tapia, D; Paterson, MJ; Migani, A; Bearpark, MJ, et al
23-Nov-2011A Hybrid Density Functional Study of Water Adsorption on Rutile TiO2(110) for Applications in Solar Hydrogen ProductionPatel, M; Mallia, G; Liborio, L; Harrison, NM
7-May-2013A hybrid-exchange density functional study of Ca-doped LaMnO3Korotana, R; Mallia, G; Gercsi, Z; Harrison, NM
9-May-2016A hybrid-exchange density functional study of the bonding and electronic structure in bulk CuFeS2Martínez-Casado, R; Chen, VH; Mallia, G; Harrison, NM
1-Jun-2016A lifetime in photochemistry; some ultrafast measurements on singlet statesPhillips, D
18-Oct-2016A lipophilic copper(II) complex as an optical probe for intracellular detection of NOVilar Compte, R; Wilson, N; Mak, LH; Cilibrizzi, A; Gee, AD, et al
1-Jan-2011A low band gap co-polymer of dithienogermole and 2,1,3-benzothiadiazole by Suzuki polycondensation and its application in transistor and photovoltaic cellsFei, Z; Kim, JS; Smith, J; Domingo, EB; Anthopoulos, TD, et al
1-Jan-2011A lyotropic inverse ribbon phase in a branched-chain polyoxyethylene surfactant: pressure effectsShearman, GC; Brooks, NJ; Tiddy, GJT; Sztucki, M; Templer, RH, et al
Collection's Items (Sorted by Title in Ascending order): 21 to 40 of 1143
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