Already have an account? Get multiple benefits of using own account!
Login in your account..!
Remember me
Don't have an account? Create your account in less than a minutes,
Forgot password? how can I recover my password now!
Enter right registered email to receive password!
Perform a Hartree-Fock geometry optimization calculation of butadiene using a minimal basis set. Repeat with the 6-311G(d,p) basis set, using the optimized minimal basis set geometry as the starting point.
(a) Compare the results of the two calculations with each other and any available experimental geometry data. Discuss the extent of agreement and the nature of any differences.
(b) Considering the 6-311G(d,p) calculation, state the symmetry and ground state electronic configuration of butadiene.
(c) Using Koopmans' theorem, predict the core electron binding energies. Include qualitative descriptions of the corresponding core molecular orbitals. Comment on the level of (dis)agreement between the two calculations.
(d) Considering the 6-311G(d,p) calculation, describe the four lowest energy unoccupied orbitals. Include the correct symmetry labels, energies, and qualitative descriptions.
(e) Which core-to-valence excitations involving the four MOs considered in part (d) are dipole allowed?
What do you understand by DRAM and its refreshing? Dynamic RAM (DRAM) is fundamentally the same as SRAM, but this retains data for only 2 or 4 ms on an internal capacitor. But
mirror circuit
A three-phase, 220-V, 60-Hz, four-pole, wye connected induction motor has a per-phase stator resistance of 0.5 . The following no-load and blocked rotor test data on the motor are
Why is the signal first attenuated and then amplified?
Condition Return Similar to conditional jump and call instructions there are conditional return instructions also based on various flags.
Working and block diagram
Name the 6 modes of operations of an 8253 programmable interval timer. Mode 0: interrupt on terminal count Mode 1: hardware re -triggerable one-shot Mode 2: rate generato
For the circuit of Figure, obtain the complete solution for the current i L (t) through the 5-H inductor and the voltage v x (t) across the 6- resistor.
Simulate and compare BER of QPSK system and 4-QAM system without grey coding Eb/No=0.2.4.6.8.10
schmitt triggering with emitter coupled transister
Get guaranteed satisfaction & time on delivery in every assignment order you paid with us! We ensure premium quality solution document along with free turntin report!
whatsapp: +1-415-670-9521
Phone: +1-415-670-9521
Email: [email protected]
All rights reserved! Copyrights ©2019-2020 ExpertsMind IT Educational Pvt Ltd