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Water total energy

Fig. 36. Energy distributions of waters in different environments in the triclinic lysozyme unit cell, (a) All waters, total energy (-----) and energy partitioned into water-... [Pg.116]

Fig. 2. The time evolution of the total energy of four water molecules (potential-energy details are given in [48]) as propagated by the symplectic Verlet method (solid) and the nonsymplectic fourth-order Runge-Kutta method (dashed pattern) for Newtonian dynamics at two timestep values. Fig. 2. The time evolution of the total energy of four water molecules (potential-energy details are given in [48]) as propagated by the symplectic Verlet method (solid) and the nonsymplectic fourth-order Runge-Kutta method (dashed pattern) for Newtonian dynamics at two timestep values.
Electrostatic Repulsive Forces. As the distance between two approaching particles decreases, their electrical double layers begin to overlap. As a first approximation, the potential energy of the two overlapping double layers is additive, which is a repulsive term since the process increases total energy. Electrostatic repulsion can also be considered as an osmotic force, due to the compression of ions between particles and the tendency of water to flow in to counteract the increased ion concentration. [Pg.148]

Energy balances differ from mass balances in that the total mass is known but the total energy of a component is difficult to express. Consequently, the heat energy of a material is usually expressed relative to its standard state at a given temperature. For example, the heat content, or enthalpy, of steam is expressed relative to liquid water at 273 K (0°C) at a pressure equal to its own vapor pressure. [Pg.364]

Ventilation around a compressor is vital. On a motor-driven, air-cooled unit, the heat radiated to the surrounding air is at least 65 per cent of the power input. On a water-jacketed unit with an aftercooler and outside receiver, the heat radiated to the surrounding air may be 15 to 25 per cent of the total energy input, which is still a substantial amount of heat. Positive outside ventilation is recommended for any compressor room where the ambient temperature may exceed 104°F. [Pg.565]

The treatment of water-metal interactions deserves even more research. This is so because when a water molecule approaches a metal surface, two types of interactions can be envisaged. One of them is due to the polarization of the metal due to the partial charges that occur on the water molecule, and the other is due to overlap of the electronic clouds of the water molecules with the electronic cloud of the metal, called chemical interactions. For a water-Pt system, the latter predominate over the former, amounting to 90% of the total energy. [Pg.664]

B the total energy in the sugar water at the end of the experiment is less than at the beginning of the experiment... [Pg.31]

Assume heat rejection from refrigeration is to cooling water. Calculate the total energy cost of the utilities,... [Pg.456]

The ballistic mortar and lead block tests use only small amounts of explosive and are not applicable to slurry explosives which are too insensitive to detonate properly under such conditions. For these explosives it is useful to fire larger amounts of several kg under water and measure the period of oscillation of the gas bubble produced. The longer the period the greater the energy of the gas bubble and this part of the total energy of the explosive has been found to correlate well with the blasting effect of the explosive. [Pg.64]

To verify the mechanism presented, the quantum-chemical calculations of proton affinity, Aa, were carried out for modifiers, since the corresponding experimental data are quite rare. The calculations were performed for isolated molecules, since the properties of species in the interlayer space are probably closer to the gas phase rather than the liquid. The values of Ah were calculated as a difference in the total energy between the initial and protonated forms of the modifier. Energies were calculated using the TZV(2df, 2p) basis and MP2 electron correlation correction. Preliminarily, geometries were fully optimized in the framework of the MP2/6-31G(d, p) calculation. The GAMESS suite of ah initio programs was employed [10]. Comparison between the calculated at 0 K proton affinities for water (7.46 eV) and dioxane (8.50 eV) and the experimental data 7.50 eV and 8.42 eV at 298 K, respectively (see [11]), demonstrates a sufficient accuracy of the calculation. [Pg.397]

The lowest two insets of Fig. 56 compares the power for suspending and transporting the solid particles NST for the G/S and L/S systems. For the FCC/air system, NST is always less than the total energy TV, until it jumps to the latter value at the point of sudden change, while for glass/water, NST is always the same as TV in view of its homogeneous nature. [Pg.573]


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See also in sourсe #XX -- [ Pg.29 ]

See also in sourсe #XX -- [ Pg.29 ]




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