화학공학소재연구정보센터
검색결과 : 10건
No. Article
1 Inverse Design of Self-Assembling Frank-Kasper Phases and Insights Into Emergent Quasicrystals
Lindquist BA, Jadrich RB, Pineros WD, Truskett TM
Journal of Physical Chemistry B, 122(21), 5547, 2018
2 Reply to "Comment on'Insights into the Electronic Structure of Ozone and Sulfur Dioxide from Generalized Valence Bond Theory: Bonding in O-3 and SO2"
Dunning TH, Takeshita TY, Lindquist BA
Journal of Physical Chemistry A, 120(1), 171, 2016
3 Insights into the Electronic Structure of Molecules from Generalized Valence Bond Theory
Dunning TH, Xu LT, Takeshita TY, Lindquist BA
Journal of Physical Chemistry A, 120(11), 1763, 2016
4 Electronic Structure of H2S, SF2, and HSF and Implications for Hydrogen-Substituted Hypervalent Sulfur Fluorides
Lindquist BA, Woon DE, Dunning TH
Journal of Physical Chemistry A, 118(7), 1267, 2014
5 Effects of Ligand Electronegativity on Recoup led Pair Bonds with Application to Sulfurane Precursors
Lindquist BA, Woon DE, Dunning TH
Journal of Physical Chemistry A, 118(30), 5709, 2014
6 Insights into the Electronic Structure of Disulfur Tetrafluoride Isomers from Generalized Valence Bond Theory
Lindquist BA, Engdahl AL, Woon DE, Dunning TH
Journal of Physical Chemistry A, 118(43), 10117, 2014
7 Photodynamics in Complex Environments: Ab Initio Multiple Spawning Quantum Mechanical/Molecular Mechanical Dynamics
Virshup AM, Punwong C, Pogorelov TV, Lindquist BA, Ko C, Martinez TJ
Journal of Physical Chemistry B, 113(11), 3280, 2009
8 Solvation dynamics of Hoechst 33258 in water: An equilibrium and nonequilibrium molecular dynamics study
Furse KE, Lindquist BA, Corcelli SA
Journal of Physical Chemistry B, 112(10), 3231, 2008
9 Nitrile groups as vibrational probes: Calculations of the C N infrared absorption line shape of acetonitrile in water and tetrahydrofuran
Lindquist BA, Corcelli SA
Journal of Physical Chemistry B, 112(20), 6301, 2008
10 Optimized Quantum Mechanics/Molecular Mechanics Strategies for Nitrile Vibrational Probes: Acetonitrile and para-Tolunitrile in Water and Tetrahydrofuran
Lindquist BA, Haws RT, Corcelli SA
Journal of Physical Chemistry B, 112(44), 13991, 2008