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1 igh fluorophilicity of [2]+ arises from both Coulombic and cooperative effects which lead to formatio
7 eld in conjunction with ReaxFF and including Coulombic and Lennard-Jones interactions is employed to
13 reveal strong intermolecular van der Waals, Coulombic, and H-bond interactions in striking agreement
14 ely; however, large losses in van der Waals, Coulombic, and H-bond interactions strongly suggest that
15 force field that includes hydrogen bonding, Coulombic, and hydrophobic terms, was used to model the
16 olenses were prepared from the particles via Coulombic assembly onto a silane-modified glass substrat
18 -binding is a competition between the strong coulombic attraction and the large cost of desolvating t
20 o nanoelectrospray ionization as a result of Coulombic attraction between positively charged protein
22 parated radical ion pair is a consequence of Coulombic attraction in the contact radical ion pair and
23 ognition process, which relies on an initial Coulombic attraction of anionic SAMs to the cationic HBS
24 is uncharged and thereby lacks the intrinsic Coulombic attraction of the phosphinate anion to the act
25 inhibited by supramolecular factors such as Coulombic attraction or repulsion between a charged gues
26 t the cytoplasmic end of TM2, is caused by a Coulombic attraction to E465, at the cytoplasmic end of
27 fs (tryptophan zipper, disulfide, d-Pro-Gly, Coulombic attraction, l-Pro-Gly) enhance formation rates
28 to membranes are determined by a long-range Coulombic attraction, the hydrophobic effect, and a shor
30 cular, strong correlations are found between Coulombic attractions and the electrostatic desolvation
31 can provide conformational stabilization via Coulombic attractions that do not require entropically c
33 s (I37K, Q40K, and V38E) lead to significant Coulombic changes that weaken favorable van der Waals in
34 sition 63 (N) at the middle of the IC1 and a Coulombic charge interaction between the positive charge
35 on potentials (alpha-values) quantifying non-Coulombic chemical interactions of KGlu with unit area o
38 ential at the polyion surface, we obtain the coulombic contribution to the salt-polyelectrolyte prefe
40 he conductivity to a decrease in the on-site Coulombic correlation energy (U), as the dimers form a s
42 and charge transfer, such as intermolecular Coulombic decay and electron-transfer mediated decay (ET
44 -) largely compensates for the destabilizing Coulombic effect of any salt on the binding of this asse
45 FrdA E49Q and SdhA Q50E mutants suggest that coulombic effects and the electronic state of the FAD ar
46 ind guests in solution; cavity enclosure and coulombic effects appear to be crucial drivers of host-g
49 it was necessary to incorporate intramonomer Coulombic effects between hemes bL and bH and intermonom
50 However, large ion populations may manifest Coulombic effects contributing to the spatial dispersion
52 ntermediate comes from studies of steric and Coulombic effects on the quenching rate constants and fr
55 volumetric energy and power density values, coulombic efficiencies in excess of 95%, and stability o
58 Li-SPAN cells cycle trouble free and at high Coulombic efficiencies in simple carbonate electrolytes.
63 g(-1) at 100 mA g(-1) after 50 cycles), high coulombic efficiency (>95%), excellent cycling stability
64 lithium deposition and significantly improve Coulombic efficiency (99% over 400 cycles at a current d
65 fter 200 cycles at 0.2C), and a high average Coulombic efficiency (99.7% from the second cycle to the
66 -electrolyte contact area, resulting in high Coulombic efficiency (99.87%) and volumetric capacity (1
67 rnately catalyzing anodic acetate oxidation (Coulombic efficiency (CE) 85.3%) and cathodic denitrific
68 t 9.35 +/- 0.28 g Fe3O4-Fe/L, resulting in a Coulombic efficiency (CE) for iron oxidation of 93.5 +/-
70 anode materials to achieve high first cycle Coulombic efficiency (CE) of >100% or serve as an excell
71 over a period of 12 weeks and had an average Coulombic efficiency (CE) of 84.1 +/- 1.1% at practicall
72 Mg electrodeposition was achieved with high Coulombic efficiency (CE) of 90% and high current densit
76 ate cycling of a lithium metal anode at high Coulombic efficiency (up to 99.1%) without dendrite grow
77 cled at 450 degrees Celsius with 98 per cent Coulombic efficiency and 73 per cent round-trip energy e
78 gh energy and power performance, nearly 100% coulombic efficiency and 85% energy efficiency after 25,
79 /- 4.35%, while the average percent error of Coulombic efficiency and COD removal rate predictions we
80 /Li2 O interface are critical to enhance the coulombic efficiency and cyclic performance of SnO2 -bas
81 nt species of VFA by using two methods i.e., coulombic efficiency and cyclic voltammetry was investig
82 60 mA h g(-1)) and lowest potential, but low Coulombic efficiency and formation of lithium dendrites
83 f lithium metal anodes suffers from the poor Coulombic efficiency and growth of lithium dendrites.
84 ransport towards the Li-metal, also has high Coulombic efficiency and kept 93 % of its capacity after
85 to achieve high sulfur utilization with high Coulombic efficiency and long cycle life of Li-S batteri
87 polymer/LLZT-2LiF/LiFePO4 battery has a high Coulombic efficiency and long cycle life; a Li-S cell wi
90 h the supramolecular capsules retains a high Coulombic efficiency and shows a large increase in capac
91 capacity of approximately 110 mAh g(-1) with Coulombic efficiency approximately 98%, at a current den
95 over the MCMB reference but present a lower Coulombic efficiency as well as a higher capacity loss p
96 to cycle up to 1000 times, with nearly 100% coulombic efficiency at both low (0.15 coulomb) and high
97 unmodified samples, which usually show rapid Coulombic efficiency decay in fewer than 100 cycles.
98 but suffer from rapid capacity fade and low Coulombic efficiency due to the high permeability of red
99 , leading to serious safety concerns and low Coulombic efficiency during charge/discharge cycles.
101 86% incommensurate sample achieves above 99% coulombic efficiency exhibiting 930 mAh g(-1) specific c
102 of approximately 1400 mA h g(-1) with a low Coulombic efficiency for the first cycle (approximately
105 ted here will be generally useful to enhance Coulombic efficiency in many electrochemical systems (e.
107 resulted in similar organic removal, but the Coulombic efficiency obtained from the MPPC was 21 times
109 ile showing excellent long-term performance (coulombic efficiency of 100 % and energy efficiency of 7
110 chieve over 260 mAh/g after 700 cycles and a Coulombic efficiency of 101.1%, without the use of harmf
112 er squared (mA cm(-2)) of applied current at coulombic efficiency of 35% (35% of the applied current
114 fic capacity of 1,030 mAh g(-1) at 0.5 C and Coulombic efficiency of 98.4% over 1,000 cycles are achi
117 close to 600 mAh g(-1) at a high rate with a Coulombic efficiency of 99 over 160 cycles, an extremely
118 raphene and stability over 100 cycles with a Coulombic efficiency of 99.3% at a current rate of 0.2 C
120 te to the electrode leading to not only high coulombic efficiency of 99.9% but also maintaining high
121 ity of 802 mAh g(-1) after 659 cycles with a Coulombic efficiency of 99.9%, which outperforms convent
122 performance is enabled by a stable half-cell coulombic efficiency of 99.97%, averaged over the first
124 apacity of approximately 100 mAh g(-1) and a Coulombic efficiency of approximately 99% over hundreds
126 t inserting sulfur into pores of carbon, the coulombic efficiency of SC/Li cell in the new DOL/D2 ele
127 lexes, plays a significant role in enhancing coulombic efficiency of the corresponding solvated Mg co
130 ectrolyte showed good cyclability and a high coulombic efficiency over 40 charge/discharge cycles.
131 ng up to 99% of their capacity and 99 +/- 1% Coulombic efficiency over 50 cycles by bulk electrolysis
132 ire arrays reaches 969.72 mAh . g(-1) with a coulombic efficiency over 99% at 500 mA . g(-1) after 50
135 A bioanode with high current density and coulombic efficiency was developed by co-immobilization
138 cific capacity of 1,540 mAh g(-1) with a 75% coulombic efficiency, and an 86% incommensurate sample a
142 ic charge/discharge capacities and excellent Coulombic efficiency, demonstrating the effectiveness of
143 near the surface, which leads to a decreased coulombic efficiency, likely because of trapped Li withi
144 new electrolyte demonstrates a close to 100% coulombic efficiency, no dendrite formation, and stable
145 be the optimized parameter toward capacity, Coulombic efficiency, stability, and rate capability enh
146 Organic loading in a fed-batch MFC affected Coulombic efficiency, which decreased from 40% at 0.66 g
158 ds the leading end toward the anode, because Coulombic (electrophoretic) forces are dominant on negat
160 model indicates that the axial range of the Coulombic end effect for ss DNA extends over approximate
163 g a simple two-state thermodynamic model for Coulombic end effects, which accounts for our finding th
164 relation of DeltaH and DeltaS parameters and Coulombic energies of the various configurations of the
165 the correlation include the change in total Coulombic energy and solvent-accessible surface area.
166 ucleus-independent chemical shift (NICS) and Coulombic energy of 15 j,k-fulvalenes (j, k = 3, 5, 7, 9
169 interplay between the long-range attractive Coulombic force, the short-range repulsive force and the
172 ller in PTH2 than PTH1) as well as repulsive Coulombic forces between amino acids of like-charge (a p
173 RNase A, and illuminate the general role of Coulombic forces between proteins and nucleic acids.
175 polar molecules can be driven by fluctuating Coulombic forces induced by flowing polar liquids at nan
180 K(obs) and on Delta H degrees (obs) dissects coulombic, Hofmeister, and osmotic contributions to thes
184 ction of an attractive side-chain/side-chain Coulombic interaction at the chain termini further stabi
185 nt on salt concentration, as expected from a coulombic interaction between a cationic side chain and
186 substitution, designed to create a favorable Coulombic interaction between ONC and a phosphoryl group
187 inally, evidence is presented that shows the Coulombic interaction between the charged analyte and cl
191 hange at the chain termini implies that this Coulombic interaction contributes before or at the trans
192 hat this potentially attractive interhelical Coulombic interaction has little or no influence on heli
194 ent of this catalysis boosting effect to the Coulombic interaction of these positive charges with the
196 pole-dipole coupling, referred to as a super-Coulombic interaction, is a result of an effective inter
198 fts in our studies indicates that additional Coulombic interactions across the nonspecific-binding in
200 ivity reflects screening of weak, repulsive, Coulombic interactions among charges separated by more t
201 cid-Ke-Base-Eg, suggesting that interhelical Coulombic interactions and a buried polar interaction ar
202 minates between guanine and adenine by using Coulombic interactions and a network of hydrogen bonds.
204 gh an initial Rayleigh instability driven by Coulombic interactions and show how the intermediate sta
205 ernst-Planck (PNP2) theory to compute (mean) Coulombic interactions and thus to examine the role of t
206 ether these data demonstrate that long-range Coulombic interactions are an important feature in catal
207 -Base-a1 heterodimer, potentially attractive Coulombic interactions are expected in both orientations
208 ing in the native protein, and the favorable Coulombic interactions are reduced at low ionic strength
211 ew tool has been used to explore the role of Coulombic interactions between a core position on one he
213 volves a very large number (>/similar 20) of coulombic interactions between DNA phosphates and positi
214 he electrostatic energy as a sum of pairwise Coulombic interactions between effective fixed atomic ch
215 esigned and synthesised peptides to show how Coulombic interactions between ionizable 2,3-diaminoprop
218 ost-guest interactions to overcome repulsive Coulombic interactions between the cationic M12L24 cages
221 such that exclusively favorable interhelical Coulombic interactions can occur only in the parallel or
223 ndence of the solvation energy; screening of Coulombic interactions contributes only in a minor way.
224 n the antiparallel orientation, interhelical Coulombic interactions favor the parallel orientation an
225 To determine the energetic consequences of Coulombic interactions for helix orientation preference,
230 bition indicates that nearly eight favorable Coulombic interactions occur in the RNase A.OVS complex.
231 t in major grooves of O pre-TS, forming most Coulombic interactions of RO and burying aromatic carbon
235 sole nucleating event; it also suggests that Coulombic interactions should be considered in the desig
237 e a detailed picture of the contributions of Coulombic interactions to binding and catalysis by RNase
238 utility, as it reflects the contribution of Coulombic interactions to the uniform binding of the bou
240 g, though small, are viewed as signatures of Coulombic interactions which support theories of polyele
242 shoe-shaped structure to engender long-range Coulombic interactions with RNase 1, which is cationic.
243 the solvent available to form complementary Coulombic interactions with the polar residues of the pr
244 nsfer process that is strongly influenced by Coulombic interactions with the proximal cubane cluster
245 olecule are ideally suited to forming strong Coulombic interactions with two contiguous phosphate gro
247 Waals interactions, (2) increased favorable Coulombic interactions, and (3) decreased unfavorable to
248 This facilitated diffusion is mediated by Coulombic interactions, as the extent is diminished by t
250 intermediate complex, which is stabilized by Coulombic interactions, prior to the formation of a Mich
258 es is driven thermodynamically by attractive Coulombic occlusion of the fourth vacant coordination si
259 s not a good discriminator of the WT; while, Coulombic or reaction field energies perform better depe
262 al neutrality occurs in these liquids due to Coulombic ordering, in which ion shells of alternating c
263 h predicted and observed for highly strained coulombic photonic crystals, suggesting possible applica
266 s and monovalent microions that interact via Coulombic potentials to simulations of macroions interac
269 first one, dominated by long-range screened Coulombic repulsion (Wigner glass) and a second one, sta
270 d across the octahedral faces, and the Ir-Ir Coulombic repulsion across shared faces that destabilize
272 rmer mutation, designed to remove a possible Coulombic repulsion between E(-3)(NR2B) and Asp-243 (PDZ
274 r the pairs on the outside--a consequence of Coulombic repulsion between the inner bipyridinium subun
276 obably a result of the reduced importance of Coulombic repulsion due to the larger size of tin and a
279 ns of small molecules and helps overcome the Coulombic repulsion of bringing two cationic species int
282 ar proton redistribution according to simple Coulombic repulsion prior to backbone cleavage into C: a
283 type-II conduction band alignment driven by coulombic repulsion that eliminates non-radiative multi-
284 on several factors that include M-M-C angle, Coulombic repulsion, alkali metal cation size, and the c
285 d dumbbell components gives rise to enhanced Coulombic repulsion, destabilizing the ground-state co-c
293 arbon-based analogue, presumably a result of Coulombic repulsions minimizing noncovalent interactions
298 s strategy of catalysis boosting by means of Coulombic stabilization of the initial Fe(0)-CO2 adduct
300 ic charge analysis provided estimates of the Coulombic work terms associated with ion pairing, DeltaG
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