Rick Muller
Rick Muller
Verified email at sandia.gov - Homepage
Title
Cited by
Cited by
Year
SymPy: symbolic computing in Python
A Meurer, CP Smith, M Paprocki, O Čertík, SB Kirpichev, M Rocklin, ...
PeerJ Computer Science 3, e103, 2017
4582017
The mechanism for unimolecular decomposition of RDX (1, 3, 5-trinitro-1, 3, 5-triazine), an ab initio study
D Chakraborty, RP Muller, S Dasgupta, WA Goddard
The Journal of Physical Chemistry A 104 (11), 2261-2272, 2000
2422000
Meccano on the nanoscale—A blueprint for making some of the world's tiniest machines
AH Flood, RJA Ramirez, WQ Deng, RP Muller, WA Goddard Iii, ...
Australian journal of chemistry 57 (4), 301-322, 2004
2372004
An extended hybrid density functional (X3LYP) with improved descriptions of nonbond interactions and thermodynamic properties of molecular systems
X Xu, Q Zhang, RP Muller, WA Goddard III
The Journal of chemical physics 122 (1), 014105, 2005
2362005
Mechanism of homogeneous Ir (III) catalyzed regioselective arylation of olefins
J Oxgaard, RP Muller, WA Goddard, RA Periana
Journal of the American Chemical Society 126 (1), 352-363, 2004
1872004
Ab initio calculations of free energy barriers for chemical reactions in solution
RP Muller, A Warshel
The Journal of Physical Chemistry 99 (49), 17516-17524, 1995
1871995
Hybrid ab initio quantum mechanics/molecular mechanics calculations of free energy surfaces for enzymatic reactions: the nucleophilic attack in subtilisin
J Bentzien, RP Muller, J Florián, A Warshel
The Journal of Physical Chemistry B 102 (12), 2293-2301, 1998
1811998
Mechanism for unimolecular decomposition of HMX (1, 3, 5, 7-tetranitro-1, 3, 5, 7-tetrazocine), an ab initio study
D Chakraborty, RP Muller, S Dasgupta, WA Goddard
The Journal of Physical Chemistry A 105 (8), 1302-1314, 2001
1652001
The gas phase reaction of singlet dioxygen with water: A water-catalyzed mechanism
X Xu, RP Muller, WA Goddard
Proceedings of the National Academy of Sciences 99 (6), 3376-3381, 2002
1392002
Chemisorption of atomic oxygen on Pt (111) from DFT studies of Pt-clusters
T Jacob, RP Muller, WA Goddard
The Journal of Physical Chemistry B 107 (35), 9465-9476, 2003
1322003
Ab initio frozen density functional calculations of proton transfer reactions in solution
T Wesolowski, RP Muller, A Warshel
The Journal of Physical Chemistry 100 (38), 15444-15449, 1996
1301996
Mechanism of the Stoddart− Heath bistable Rotaxane molecular switch
WQ Deng, RP Muller, WA Goddard
Journal of the American Chemical Society 126 (42), 13562-13563, 2004
972004
Mechanism of direct molecular oxygen insertion in a palladium (II)− hydride bond
JM Keith, RP Muller, RA Kemp, KI Goldberg, WA Goddard, J Oxgaard
Inorganic chemistry 45 (24), 9631-9633, 2006
912006
Enhancement-mode double-top-gated metal-oxide-semiconductor nanostructures with tunable lateral geometry
EP Nordberg, GA Ten Eyck, HL Stalford, RP Muller, RW Young, K Eng, ...
Physical Review B 80 (11), 115331, 2009
902009
A candidate for hydrogen storage: Crystal structures and reaction mechanisms of intermediate phases
JK Kang, SY Kim, YS Han, RP Muller, WA Goddard III
Applied Physics Letters 87 (11), 111904, 2005
812005
Computational insights on the challenges for polymerizing polar monomers
DM Philipp, RP Muller, WA Goddard, J Storer, M McAdon, M Mullins
Journal of the American Chemical Society 124 (34), 10198-10210, 2002
732002
A Detailed Model for the Decomposition of Nitramines: RDX and HMX
D Chakraborty, RP Muller, S Dasgupta, WA Goddard
Journal of computer-aided materials design 8 (2), 203-212, 2001
732001
Pseudospectral generalized valence‐bond calculations: Application to methylene, ethylene, and silylene
JM Langlois, RP Muller, TR Coley, WA Goddard III, MN Ringnalda, Y Won, ...
The Journal of Chemical Physics 92 (12), 7488-7497, 1990
731990
Hydrogenolysis of palladium (II) hydroxide and methoxide pincer complexes
GR Fulmer, RP Muller, RA Kemp, KI Goldberg
Journal of the American Chemical Society 131 (4), 1346-1347, 2009
672009
Copolymerization studies of vinyl chloride and vinyl acetate with ethylene using a transition-metal catalyst
HW Boone, PS Athey, MJ Mullins, D Philipp, R Muller, WA Goddard
Journal of the American Chemical Society 124 (30), 8790-8791, 2002
672002
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