Home News About Us Contact Contributors Disclaimer Privacy Policy Help FAQ

Home
Search
Quick Search
Advanced
Fulltext
Browse
Collections
Persons
My eDoc
Session History
Login
Name:
Password:
Documentation
Help
Support Wiki
Direct access to
document ID:


          Display Documents


Institute:
Collection:
Print in Citation style Print version     Display:
Sort by: Display records with Fulltext only
Entries: 1-10  
 Basket 
Coupled cluster benchmarks of water monomers and dimers
extracted from density-functional theory liquid water: The importance of monomer deformations
Authors: Santra, Biswajit; Michaelides, Angelos; Scheffler, Matthias
Date of Publication (YYYY-MM-DD): 2009-09-25
Title of Journal: The Journal of Chemical Physics
Volume: 131
Issue / Number: 12
Start Page: 124509-1
End Page: 124509-9
Document Type: Article
ID: 435528.0
 
Full text / Content available
Experimental and theoretical study of oxygen adsorption structures on Ag(111)
Authors: Schnadt, Joachim; Knudsen, Jan; Hu, Xiao Liang; Michaelides, Angelos; Vang, Ronnie T.; Reuter, Karsten; Li, Zheshen; Lægsgaard, Erik; Scheffler, Matthias; Besenbacher, Flemming
Date of Publication (YYYY-MM-DD): 2009-08-19
Title of Journal: Physical Review B
Volume: 80
Issue / Number: 7
Start Page: 075424-1
End Page: 075424-10
Document Type: Article
ID: 433561.0
 
Full text / Content available
Local investigation of femtosecond laser induced dynamics of
water nanoclusters on Cu(111)
Authors: Mehlhorn, Michael; Carrasco, Javier; Michaelides, Angelos; Morgenstern, Karina
Date of Publication (YYYY-MM-DD): 2009-07-10
Title of Journal: Physical Review Letters
Volume: 103
Issue / Number: 2
Start Page: 026101-1
End Page: 026101-4
Document Type: Article
ID: 430783.0
 
Full text / Content available
Insight from first principles into the nature of the bonding between water molecules and 4d metal surfaces
Authors: Carrasco, Javier; Michaelides, Angelos; Scheffler, Matthias
Date of Publication (YYYY-MM-DD): 2009-05-11
Title of Journal: The Journal of Chemical Physics
Volume: 130
Issue / Number: 18
Start Page: 184707-1
End Page: 184707-11
Document Type: Article
ID: 429749.0
A one-dimensional ice structure built from pentagons
Authors: Carrasco, Javier; Michaelides, Angelos; Forster, Matthew; Haq, Sam; Raval, Rasmita; Hodgson, Andrew
Date of Publication (YYYY-MM-DD): 2009-05
Title of Journal: Nature Materials
Volume: 8
Start Page: 427
End Page: 431
Document Type: Article
ID: 401250.0
How strong is the bond between water and salt?
Authors: Li, Bo; Michaelides, Angelos; Scheffler, Matthias
Date of Publication (YYYY-MM-DD): 2008-12-01
Title of Journal: Surface Science
Volume: 602
Issue / Number: 23
Start Page: L135
End Page: L138
Document Type: Article
ID: 378908.0
On the accuracy of density-functional theory exchange-correlation functionals for H bonds in small water clusters. II. The water hexamer and van der Waals interactions.
Authors: Santra, Biswajit; Michaelides, Angelos; Fuchs, Martin; Tkatchenko, Alexandre; Filippi, Claudia; Scheffler, Matthias
Date of Publication (YYYY-MM-DD): 2008-11-20
Title of Journal: Journal of Chemical Physics
Volume: 129
Issue / Number: 19
Start Page: 194111-1
End Page: 194111-14
Document Type: Article
ID: 379152.0
 
Full text / Content available
Surface energy and surface proton order of ice Ih
Authors: Pan, Ding; Liu, Li-Min; Tribello, Gareth A.; Slater, Ben; Michaelides, Angelos; Wang, Enge
Date of Publication (YYYY-MM-DD): 2008-10-09
Title of Journal: Physical Review Letters
Volume: 101
Issue / Number: 15
Start Page: 155703-1
End Page: 155703-4
Document Type: Article
ID: 376592.0
 
Full text / Content available
Manipulation and control of hydrogen bond dynamics in adsorbed ice nanoclusters
Authors: Gawronski, Heiko; Carrasco, Javier; Michaelides, Angelos; Morgenstern, Karina
Date of Publication (YYYY-MM-DD): 2008-09-24
Title of Journal: Physical Review Letters
Volume: 101
Issue / Number: 13
Start Page: 136102-1
End Page: 136102-4
Document Type: Article
ID: 374407.0
 
Full text / Content available
Density oscillations in a nanoscale water film on salt: Insight from ab initio molecular dynamics
Authors: Liu, Limin; Krack, Matthias; Michaelides, Angelos
Date of Publication (YYYY-MM-DD): 2008-06-13
Title of Journal: Journal of the American Chemical Society
Volume: 130
Issue / Number: 27
Start Page: 8572
End Page: 8573
Document Type: Article
ID: 361911.0
Entries: 1-10  
The scope and number of records on eDoc is subject to the collection policies defined by each institute - see "info" button in the collection browse view.