Theoretical studies of the erosion of (100) and (111) diamond surfaces by hyperthermal O(3P)

Journal of Physical Chemistry C

Volumn 115, Issue 30, 2011, Pages 14770-14777

  Paci, Jeffrey T ^a,b   Schatz, George C ^b   Minton, Timothy K ^c  

^a UNIVERSITY OF VICTORIA   (Canada)

^b NORTHWESTERN UNIVERSITY   (United States)

^c MONTANA STATE UNIVERSITY   (United States)

Author keywords

[No Author keywords available]

Indexed keywords

CARBON ATOMS; DIAMOND SURFACES; DIRECT DYNAMICS; ELECTROPHILES; ELECTROPHILIC ATTACK; FUNCTIONALIZATIONS; HYDROGEN ATOMS; HYDROXYL RADICALS; INITIAL STAGES; KETONE GROUP; OXYGEN ATOM; SELF-CONSISTENT CHARGES; STEADY-STATE CONDITION; SURFACE CARBON; THEORETICAL STUDY; TIGHT BINDING; WATER MOLECULE;

ATOMS; CARBON DIOXIDE; DANGLING BONDS; EROSION; ETHERS; FUNCTIONAL GROUPS; KETONES; MOLECULES; OXYGEN;

DENSITY FUNCTIONAL THEORY;

EID: 79961054127     PISSN: 19327447     EISSN: 19327455     Source Type: Journal    
DOI: 10.1021/jp201563m     Document Type: Article

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