Research output: Contribution to journal › Article › peer-review
Imidometallanes and their heavy analogs : Rich gas phase chemistry of ring and cluster compounds. / Timoshkin, Alexey Y.
In: Inorganic Chemistry Communications, Vol. 6, No. 3, 01.03.2003, p. 274-277.Research output: Contribution to journal › Article › peer-review
}
TY - JOUR
T1 - Imidometallanes and their heavy analogs
T2 - Rich gas phase chemistry of ring and cluster compounds
AU - Timoshkin, Alexey Y.
PY - 2003/3/1
Y1 - 2003/3/1
N2 - Thermodynamic properties of the group 13-15 pnictidometallanes [HMYH]n, (M = Al, Ga, In; Y = N, P, As; n = 1-16) have been predicted at the B3LYP/LANL2DZ(d,p) level of theory. Process of the gas phase generation of [HMYH]n clusters is favorable thermodynamically at low temperatures. Al and N-containing clusters are predicted to be exceptionally stable. Spontaneous generation of [RMYH]n oligomers with n = 12-14 is expected during chemical vapor deposition processes at low temperature-high pressure conditions.
AB - Thermodynamic properties of the group 13-15 pnictidometallanes [HMYH]n, (M = Al, Ga, In; Y = N, P, As; n = 1-16) have been predicted at the B3LYP/LANL2DZ(d,p) level of theory. Process of the gas phase generation of [HMYH]n clusters is favorable thermodynamically at low temperatures. Al and N-containing clusters are predicted to be exceptionally stable. Spontaneous generation of [RMYH]n oligomers with n = 12-14 is expected during chemical vapor deposition processes at low temperature-high pressure conditions.
KW - 13-15 coordination compounds
KW - Clusters
KW - Quantum chemistry
KW - Thermodynamics
UR - http://www.scopus.com/inward/record.url?scp=0037362527&partnerID=8YFLogxK
U2 - 10.1016/S1387-7003(02)00745-1
DO - 10.1016/S1387-7003(02)00745-1
M3 - Article
AN - SCOPUS:0037362527
VL - 6
SP - 274
EP - 277
JO - Inorganic Chemistry Communication
JF - Inorganic Chemistry Communication
SN - 1387-7003
IS - 3
ER -
ID: 17373559