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Journal Article
Adsorbing CNCl on pristine, C-, and Al-doped boron nitride nanotubes: A density functional theory study
Elsevier BV
0
184
0
0
WL-CB-PP-VH-MD__BackmappingCGmacromol_20_J.Chem.Phys..pdf.jpg
Journal Article
Backmapping coarse-grained macromolecules: An efficient and versatile machine learning approach
AIP Publishing
1
669
0
1
Journal Article
Dynamics of H + HeH<sup>+</sup>(<i>v</i> = 0, <i>j</i> = 0) → H<sub>2</sub><sup>+</sup> + He: Insight on the Possible Complex-F...
American Chemical Society (ACS)
0
149
0
0
The_effect_of_chemical_constitution_on_polyisoprene_dynamics (1).pdf.jpg
Journal Article
The effect of chemical constitution on polyisoprene dynamics
AIP Publishing
1
213
0
0
Journal Article
Electronic Structure, Stability, and Electrical Mobility of Cationic Silver Oxide Atomic Clusters
Suleymanov, YurySchmidt, AndreasBiskos, George
American Chemical Society (ACS)
0
176
0
0
Journal Article
Experimental and theoretical studies of the gas-phase reactions of O(1</sup>D) with H<sub>2</sub>O and D<sub>2</sub>O at low te...
Royal Society of Chemistry (RSC)
0
156
0
0
Journal Article
Experimental and Theoretical Study of the O(<sup>1</sup>D) + HD Reaction
American Chemical Society (ACS)
0
184
0
0
2021_PCCP_Bhowmick.pdf.jpg
Journal Article
Isotopic separation of helium through graphyne membranes: a ring polymer molecular dynamics study
Royal Society of Chemistry (RSC)
1
217
0
0
Journal Article
Kinetic study of the CN + C<sub>2</sub>H<sub>6</sub> hydrogen abstraction reaction based on an analytical potential energy surface
Royal Society of Chemistry (RSC)
0
166
0
0
c8cp05398g.pdf.jpg
Journal Article
The low temperature D+ + H2 → HD + H+ reaction rate coefficient: a ring polymer molecular dynamics and quasi-classical trajecto...
Royal Society of Chemistry (RSC)
1
246
0
0
Journal Article
Lowest electronic states of neutral and ionic <scp>LiN</scp>
Bhowmick, Somnath
Wiley
0
140
0
0
JCP23-AR-POLY2023-04304.pdf.jpg
Journal Article
Temperature dependence of the dynamics and interfacial width in nanoconfined polymers via atomistic simulations
AIP Publishing
1
141
0
0