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Dmitry Zubarev
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Developing paradigms of chemical bonding: adaptive natural density partitioning
DY Zubarev, AI Boldyrev
Physical Chemistry Chemical Physics 10 (34), 5207-5217, 2008
12672008
Quantum Monte Carlo and related approaches
BM Austin, DY Zubarev, WA Lester Jr
Chemical reviews 112 (1), 263-288, 2012
3292012
A Photoelectron Spectroscopic and Theoretical Study of B16 and B162−: An All-Boron Naphthalene
AP Sergeeva, DY Zubarev, HJ Zhai, AI Boldyrev, LS Wang
Journal of the American Chemical Society 130 (23), 7244-7246, 2008
2812008
Revealing intuitively assessable chemical bonding patterns in organic aromatic molecules via adaptive natural density partitioning.
DY Zubarev, AI Boldyrev
The Journal of Organic Chemistry 73 (23), 9251-9258, 2008
2612008
Comprehensive analysis of chemical bonding in boron clusters
DY Zubarev, AI Boldyrev
Journal of computational chemistry 28 (1), 251-268, 2007
2502007
Aromaticity and antiaromaticity in transition-metal systems
DY Zubarev, BB Averkiev, HJ Zhai, LS Wang, AI Boldyrev
Physical Chemistry Chemical Physics 10 (2), 257-267, 2008
2172008
Sn122-: Stannaspherene
LF Cui, X Huang, LM Wang, DY Zubarev, AI Boldyrev, J Li, LS Wang
Journal of the American Chemical Society 128 (26), 8390-8391, 2006
1952006
Global minimum structure searches via particle swarm optimization
ST Call, DY Zubarev, AI Boldyrev
Journal of computational chemistry 28 (7), 1177-1186, 2007
1822007
Carbon Avoids Hypercoordination in CB6, CB62−, and C2B5 Planar Carbon−Boron Clusters
BB Averkiev, DY Zubarev, LM Wang, W Huang, LS Wang, AI Boldyrev
Journal of the American Chemical Society 130 (29), 9248-9250, 2008
1672008
δ Aromaticity in [Ta3O3]
HJ Zhai, BB Averkiev, DY Zubarev, LS Wang, AI Boldyrev
Angewandte Chemie 119 (23), 4355-4358, 2007
1612007
Deciphering chemical bonding in golden cages
DY Zubarev, AI Boldyrev
The Journal of Physical Chemistry A 113 (5), 866-868, 2009
1452009
Gold apes hydrogen. The structure and bonding in the planar B7Au2-and B7Au2 clusters
HJ Zhai, LS Wang, DY Zubarev, AI Boldyrev
The Journal of Physical Chemistry A 110 (5), 1689-1693, 2006
1442006
Complex chemical reaction networks from heuristics-aided quantum chemistry
D Rappoport, CJ Galvin, DY Zubarev, A Aspuru-Guzik
Journal of chemical theory and computation 10 (3), 897-907, 2014
1402014
Combinatorial polyacrylamide hydrogels for preventing biofouling on implantable biosensors
D Chan, JC Chien, E Axpe, L Blankemeier, SW Baker, S Swaminathan, ...
Advanced Materials 34 (24), 2109764, 2022
682022
Chiral sugars drive enantioenrichment in prebiotic amino acid synthesis
AJ Wagner, DY Zubarev, A Aspuru-Guzik, DG Blackmond
ACS Central Science 3 (4), 322-328, 2017
562017
Uncertainty of Prebiotic Scenarios: The Case of the Non-Enzymatic Reverse Tricarboxylic Acid Cycle
D Zubarev, D Rappoport, A Aspuru-Guzik
Scientific Reports 5, 8009, 2015
562015
Pathways to soot oxidation: reaction of OH with phenanthrene radicals
DE Edwards, DY Zubarev, WA Lester Jr, M Frenklach
The Journal of Physical Chemistry A 118 (37), 8606-8613, 2014
542014
On the Chemical Bonding of Gold in Auro-Boron Oxide Clusters AunBO- (n = 1−3)
DY Zubarev, AI Boldyrev, J Li, HJ Zhai, LS Wang
The Journal of Physical Chemistry A 111 (9), 1648-1658, 2007
522007
Bay-capping reactions: Kinetics and influence on graphene-edge growth
X You, R Whitesides, D Zubarev, WA Lester Jr, M Frenklach
Proceedings of the Combustion Institute 33 (1), 685-692, 2011
422011
Thermal decomposition of pentacene oxyradicals
X You, DY Zubarev, WA Lester Jr, M Frenklach
The Journal of Physical Chemistry A 115 (49), 14184-14190, 2011
402011
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Artikler 1–20