TY  - JOUR
T1  - Introduction to Active Thermochemical Tables:  Several “Key” Enthalpies of Formation Revisited
AU  - Ruscic, Branko
AU  - Pinzon, Reinhardt E.
AU  - Morton, Melita L.
AU  - von Laszevski, Gregor
AU  - Bittner, Sandra J.
AU  - Nijsure, Sandeep G.
AU  - Amin, Kaizar A.
AU  - Minkoff, Michael
AU  - Wagner, Albert F.
Y1  - 2004/11/01
PY  - 2004
DA  - 2004/11/01
N1  - doi: 10.1021/jp047912y
DO  - 10.1021/jp047912y
T2  - The Journal of Physical Chemistry A
JF  - The Journal of Physical Chemistry A
JO  - J. Phys. Chem. A
SP  - 9979
EP  - 9997
VL  - 108
IS  - 45
PB  - American Chemical Society
SN  - 1089-5639
M3  - doi: 10.1021/jp047912y
UR  - https://doi.org/10.1021/jp047912y
ER  - 
TY  - JOUR
DO  - 10.1088/1742-6596/16/1/078
UR  - http://dx.doi.org/10.1088/1742-6596/16/1/078
TI  - Active Thermochemical Tables: thermochemistry for the 21st century
T2  - Journal of Physics: Conference Series
AU  - Ruscic, Branko
AU  - Pinzon, Reinhardt E
AU  - Laszewski, Gregor von
AU  - Kodeboyina, Deepti
AU  - Burcat, Alexander
AU  - Leahy, David
AU  - Montoy, David
AU  - Wagner, Albert F
PY  - 2005
DA  - 2005/01/01
PB  - IOP Publishing
SP  - 561-570
VL  - 16
SN  - 1742-6588
SN  - 1742-6596
ER  - 
TY  - ELEC
TI  - Active Thermochemical Tables (ATcT) values based on ver. 1.122d of the Thermochemical Network
AU  - Ruscic, Branko
AU  - Bross, David H.
PY  - 2018
UR  - https://ATcT.anl.gov
ER  -
TY  - JOUR
T1  - Bond Dissociation Energies for Diatomic Molecules Containing 3d Transition Metals: Benchmark Scalar-Relativistic Coupled-Cluster Calculations for 20 Molecules
AU  - Cheng, Lan
AU  - Gauss, Jürgen
AU  - Ruscic, Branko
AU  - Armentrout, Peter B.
AU  - Stanton, John F.
Y1  - 2017/03/14
PY  - 2017
DA  - 2017/03/14
N1  - doi: 10.1021/acs.jctc.6b00970
DO  - 10.1021/acs.jctc.6b00970
T2  - Journal of Chemical Theory and Computation
JF  - Journal of Chemical Theory and Computation
JO  - J. Chem. Theory Comput.
SP  - 1044
EP  - 1056
VL  - 13
IS  - 3
PB  - American Chemical Society
SN  - 1549-9618
M3  - doi: 10.1021/acs.jctc.6b00970
UR  - https://doi.org/10.1021/acs.jctc.6b00970
ER  - 
TY  - JOUR
T1  - Thermal Decomposition of Potential Ester Biofuels. Part I: Methyl Acetate and Methyl Butanoate
AU  - Porterfield, Jessica P.
AU  - Bross, David H.
AU  - Ruscic, Branko
AU  - Thorpe, James H.
AU  - Nguyen, Thanh Lam
AU  - Baraban, Joshua H.
AU  - Stanton, John F.
AU  - Daily, John W.
AU  - Ellison, G. Barney
Y1  - 2017/06/22
PY  - 2017
DA  - 2017/06/22
N1  - doi: 10.1021/acs.jpca.7b02639
DO  - 10.1021/acs.jpca.7b02639
T2  - The Journal of Physical Chemistry A
JF  - The Journal of Physical Chemistry A
JO  - J. Phys. Chem. A
SP  - 4658
EP  - 4677
VL  - 121
IS  - 24
PB  - American Chemical Society
SN  - 1089-5639
M3  - doi: 10.1021/acs.jpca.7b02639
UR  - https://doi.org/10.1021/acs.jpca.7b02639
ER  - 
TY  - JOUR
T1  - Uncertainty quantification in thermochemistry, benchmarking electronic structure computations, and Active Thermochemical Tables
AU  - Ruscic, Branko
Y1  - 2014/09/05
PY  - 2014
DA  - 2014/09/05
N1  - doi: 10.1002/qua.24605
DO  - 10.1002/qua.24605
T2  - International Journal of Quantum Chemistry
JF  - International Journal of Quantum Chemistry
JO  - International Journal of Quantum Chemistry
JA  - Int. J. Quantum Chem.
SP  - 1097
EP  - 1101
VL  - 114
IS  - 17
KW  - enthalpies of formation
KW  - accuracy
KW  - mean absolute deviation
KW  - benchmark sets
KW  - experiment-theory interface
PB  - John Wiley & Sons, Ltd
SN  - 0020-7608
M3  - doi: 10.1002/qua.24605
UR  - https://doi.org/10.1002/qua.24605
Y2  - 2019/06/11
ER  -