A series of calculations has been carried out to examine the relationship b
etween gas phase composition and film composition in diamond chemical vapor
deposition. It is predicted that the ability to carry out in situ doping o
f films with N and S, and the inability to dope with O, can be explained fr
om a simple thermodynamic perspective. Probable precursor dopant species ar
e identified as . CN and . SH for the CH4/H-2/N-2 and CH4/H-2/H2S systems,
although it is expected that these are the most likely precursors regardles
s of the initial forms of nitrogen and sulfur. (C) 2001 Elsevier Science B.
V. All rights reserved.