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Zitiert von
Zitiert von
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Gas hydrates in sustainable chemistry
A Hassanpouryouzband, E Joonaki, MV Farahani, S Takeya, C Ruppel, ...
Chemical society reviews 49 (15), 5225-5309, 2020
2932020
Photo-induced Charge Separation across the Graphene–TiO2 Interface Is Faster than Energy Losses: A Time-Domain ab Initio Analysis
R Long, NJ English, OV Prezhdo
Journal of the American Chemical Society 134 (34), 14238-14248, 2012
2302012
Perspectives on external electric fields in molecular simulation: progress, prospects and challenges
NJ English, CJ Waldron
Physical Chemistry Chemical Physics 17 (19), 12407-12440, 2015
1732015
Molecular dynamics simulations of microwave heating of water
NJ English, JMD MacElroy
The Journal of chemical physics 118 (4), 1589-1592, 2003
1612003
Perspectives on molecular simulation of clathrate hydrates: Progress, prospects and challenges
NJ English, JMD MacElroy
Chemical Engineering Science 121, 133-156, 2015
1572015
Synergistic effects on band gap-narrowing in titania by codoping from first-principles calculations
R Long, NJ English
Chemistry of Materials 22 (5), 1616-1623, 2010
1552010
Molecular-dynamics simulations of methane hydrate dissociation
NJ English, JK Johnson, CE Taylor
The Journal of chemical physics 123 (24), 244503, 2005
1522005
Thermal conductivity of methane hydrate from experiment and molecular simulation
EJ Rosenbaum, NJ English, JK Johnson, DW Shaw, RP Warzinski
The Journal of Physical Chemistry B 111 (46), 13194-13205, 2007
1512007
Theoretical studies of the kinetics of methane hydrate crystallization in external electromagnetic fields
NJ English, JMD MacElroy
The Journal of chemical physics 120 (21), 10247-10256, 2004
1402004
First-principles calculation of nitrogen-tungsten codoping effects on the band structure of anatase-titania
R Long, NJ English
Applied physics letters 94 (13), 132102, 2009
1272009
Hydrogen bonding and molecular mobility in liquid water in external electromagnetic fields
NJ English, JMD MacElroy
The Journal of chemical physics 119 (22), 11806-11813, 2003
1242003
Structural and dynamical properties of methane clathrate hydrates
NJ English, JMD MacElroy
Journal of computational chemistry 24 (13), 1569-1581, 2003
1122003
Band gap engineering of (N, Ta)-codoped TiO2: A first-principles calculation
R Long, NJ English
Chemical Physics Letters 478 (4-6), 175-179, 2009
1112009
Controlled semiconductor nanorod assembly from solution: influence of concentration, charge and solvent nature
A Singh, RD Gunning, S Ahmed, CA Barrett, NJ English, JA Garate, ...
Journal of Materials Chemistry 22 (4), 1562-1569, 2012
962012
Denaturation of hen egg white lysozyme in electromagnetic fields: A molecular dynamics study
NJ English, DA Mooney
The Journal of Chemical Physics 126 (9), 03B401, 2007
952007
Molecular dynamics study of water in contact with the TiO2 rutile-110, 100, 101, 001 and anatase-101, 001 surface
RS Kavathekar, P Dev, NJ English, JMD MacElroy
Molecular Physics 109 (13), 1649-1656, 2011
932011
Methane clathrate hydrate nucleation mechanism by advanced molecular simulations
M Lauricella, S Meloni, NJ English, B Peters, G Ciccotti
The Journal of Physical Chemistry C 118 (40), 22847-22857, 2014
902014
Nonequilibrium molecular dynamics study of electric and low-frequency microwave fields on hen egg white lysozyme
NJ English, GY Solomentsev, P O’Brien
The Journal of chemical physics 131 (3), 07B614, 2009
902009
Magnetic properties of first-row element-doped ZnS semiconductors: A density functional theory investigation
R Long, NJ English
Physical Review B 80 (11), 115212, 2009
892009
Mechanisms for thermal conduction in methane hydrate
NJ English, ST John
Physical review letters 103 (1), 015901, 2009
892009
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