Since V is a state function , Euler's reciprocity Opplies, le (유() -(()7 %3D JT lav knowing this, show that the van der Waals equation lof state is a state function. P= nRT V- nb n²a
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- Give clear handwritten answer of all subparts!Consider the following statements about population analysis and decipher if they are True (T), False (F) or indeterminable (i.e. more information is needed) Most population analysis is basis set dependent to some extent → this is (T, For l) Bond Critical points in the Bader charge analysis correspond to points of minimum electron charge density between two bound atoms → this is (T, F or l) Off diagonal terms (wrt to basis functions) in Mulliken population analysis are split evenly between the atoms the basis functions come from → this is (T, F or l)If [CH4}) = 0.1M; [O2] = 0.25M\[CO2 ]= 0.35M and [H2O] = 0.15M what is the value of Qc?
- 5..How many basis functions are there for H2O in 6-31G* and cc-pTVZ and why?why is lupac for Hg2Cl2 Mercury (I) Chloride, instead of Mercury (II) Chloride?for C2H2 1- Calculate the separation at which the minimum of the potential energy occur.2- verify that at this minimum the potential energy V = ─ .3- Choose values of r such that all characteristic points and areas are shown clearly on the graph. Let the x-axis be r in pm
- Calculate f(E), the probability predicted by the Fermi–Dirac distribution, for the case where the energy E is the thermal energy, kT, above the Fermi energy: E = EF + kT.P10C.8 Consider the molecule F2C=CF2 (point group D2h), and take it as lying in the xy-plane, with x directed along the C–C bond. (a) Consider a basis formed from the four 2pz orbitals from the fluorine atoms: show that the basis spans B1u, B2g, B3g, and Au. (b) By applying the projection formula to one of the 2pz orbitals, generate the SALCs with the indicated symmetries. (c) Repeat the process for a basis formed from four 2px orbitals (the symmetry species will be different from those for 2pz).Give relation between delta S and orientaion of molecule.
- Why is spin-pairing so common a features of bond formation (in the context of valence-bond theory)? Please answer ASAP in detailConsider the character table given below for the point group D3h, which includes molecules like cyclopropane and BF3. Suppose has been already determined a reducible representation for the collective motions of one such molecule, Γ(3N). What combination of irreps should we remove from it to account for translations & rotations, thereby yielding the purely vibrational representation, Γvib?-What values of J are consistent with the terms 2P and 3D? How many states with different values of MJ correspond to each? -Describe the symmetry-adapted core and valence orbitals of H2O and H2S in the C2v point group