Defects and metastable structures of MgAl{sub 2}O{sub 4}
R.W. Grimes , S. Vyas , M. Yan , S.P. Chen
97. American Ceramic Society (ACS) annual meeting and exposition, Cincinnati, OH (United States), 1-4 May 1995
1995
Oxygen vacancy migration in disordered Gd{sub 2}(Zr{sub x}Ti{sub 1{minus}x}){sub 2}O{sub 7}
J.D. Gale , W.J. Weber , R.E. Williford , R. Devanathan
Materials Research Society, Warrendale, PA (US)
1999
An ab initio study of methanol adsorption in zeolites
J.D. Gale , C.R.A. Catlow , J.R. Carruthers
Chemical Physics Letters 216 ( 1-2) 155 -161
78
1993
First principles studies of the surface of galena PbS
J. Muscat , J.D. Gale
Geochimica et Cosmochimica Acta 67 ( 5) 799 -805
23
2003
16-P-15 - Computational studies of the calcination of fluorinated gallo-phosphates: exploration of their template-free calcined forms
S. Girard , J.D. Gale , C. Mellot-Draznieks , G. Férey
Studies in Surface Science and Catalysis 135 267
2
2001
Methanol in microporous materials from first principles
J.D. Gale , R. Shah , M.C. Payne , I. Stich
Catalysis Today 50 ( 3) 525 -532
29
1999
Surface structure determination of zeolites
B. Slater , J.D. Gale , C.R.A. Catlow , T. Ohsuna
Studies in Surface Science and Catalysis 154 1197 -1203
6
2004
Topological and geometrical characterization of zeotypes with a free software code called zeotsites: The case study of germanium location in octadecasil
G. Sastre , J.D. Gale
Studies in Surface Science and Catalysis 154 1261 -1266
2
2004
A new class of self-assembled monolayers on gold using an alkynyl group as a linker
M.J. Ford , R.C. Hoft , J.D. Gale , A.M. Mcdonagh
international conference on nanoscience and nanotechnology
1
2006
Modelling of structure and reactivity in zeolites
C.R.A. Catlow , R.G. Bell , J.D. Gale , D.W. Lewis
Studies in Surface Science and Catalysis 97 87 -100
38
1995
Chemical and Thermal Expansion of Calcium-Doped Lanthanum Chromite
R.E. Williford , T.R. Armstrong , J.D. Gale
Journal of Solid State Chemistry 149 ( 2) 320 -326
9
2000
Atomic Structure of the (0001) Corundum Surface
V.E. Puchin , J.D. Gale , A.L. Shluger , Eugene A. Kotomin
Materials Science Forum 633 -636
1997
Oxygen Vacancy Migration in Disordered Gd2(ZrxTi1-x)2O7
R.E. Williford , W.J. Weber , R. Devanathan , J.D. Gale
MRS Proceedings 538 235
1
1998
Recent Computational Studies in Solid State Chemistry
C.R.A. Catlow , J.D. Gale , R.W. Grimes
Journal of Solid State Chemistry 106 ( 1) 13 -26
23
1993
Effects of cation disorder on oxygen vacancy migration in Gd2Ti2O7
R.E. Williford , W.J. Weber , R. Devanathan , J.D. Gale
Journal of Electroceramics 3 ( 4) 409 -424
74
1999
An efficient technique for calculating solvation effects on surface structures and energetics
A.L. Rohl , J.D. Gale
Geochimica et Cosmochimica Acta 70 ( 18) A537
2006
Atomic and electronic structure of the corundum (0001) surface: comparison with surface spectroscopies
V.E. Puchin , J.D. Gale , A.L. Shluger , E.A. Kotomin
Surface Science 370 ( 2-3) 190 -200
89
1997
Three-dimensional kinetic Monte Carlo simulation of crystal growth from solution
S. Piana , J.D. Gale
Journal of Crystal Growth 294 ( 1) 46 -52
30
2006
The influence of metal ion inclusion on the morphology of gibbsite
A. L. Rohl , G. M. Parkinson , J. D. Gale , F. J. Lincoln
Chemical Engineering Research & Design 74 ( 7) 739 -743
5
1996