검색결과 : 52건
No. | Article |
---|---|
1 |
Metastability and no criticality Reply Palmer JC, Martelli F, Liu Y, Car R, Panagiotopoulos AZ, Debenedetti PG Nature, 531(7593), E2, 2016 |
2 |
Metastable liquid-liquid transition in a molecular model of water Palmer JC, Martelli F, Liu Y, Car R, Panagiotopoulos AZ, Debenedetti PG Nature, 510(7505), 385, 2014 |
3 |
Enhanced Thermal Decomposition of Nitromethane on Functionalized Graphene Sheets: Ab Initio Molecular Dynamics Simulations Liu LM, Car R, Selloni A, Dabbs DM, Aksay IA, Yetter RA Journal of the American Chemical Society, 134(46), 19011, 2012 |
4 |
Electrocatalyst design from first principles: A hydrogen-production catalyst inspired by nature Zipoli F, Car R, Cohen MH, Selloni A Catalysis Today, 165(1), 160, 2011 |
5 |
Simple, Unambiguous Theoretical Approach to Oxidation State Determination via First-Principles Calculations Sit PHL, Car R, Cohen MH, Selloni A Inorganic Chemistry, 50(20), 10259, 2011 |
6 |
Simulation of Electrocatalytic Hydrogen Production by a Bioinspired Catalyst Anchored to a Pyrite Electrode Zipoli F, Car R, Cohen MH, Selloni A Journal of the American Chemical Society, 132(25), 8593, 2010 |
7 |
A model approach to modelling Car R, Parrinello M Nature Materials, 9(9), 687, 2010 |
8 |
From ab initio onwards Pulizzi F, Car R Nature Materials, 9(9), 694, 2010 |
9 |
Charge Transfer in Partition Theory Cohen MH, Wasserman A, Car R, Burke K Journal of Physical Chemistry A, 113(10), 2183, 2009 |
10 |
Hydrogen Production by the Naked Active Site of the Di-iron Hydrogenases in Water Zipoli F, Car R, Cohen MH, Selloni A Journal of Physical Chemistry B, 113(39), 13096, 2009 |