Write down the distance matrix for H2O using the experimental geometry in Table 15.2. Take oxygen as
Question:
Transcribed Image Text:
Basis Set STO-3G, 7 3-21G. 13 Minimal STO, 7 6-31G, 19 6-31G,25 cc-pVDZ, 24 Rom/A Reference CCCBDEB CCCBDB Pitzer, Merrifield CCCBDB CCCBDB CCCBDE K. S. Kim et al CCCBDE CCCBDE Dunning et al. Rosenberg et al CCCBDE CCCBDB Amos K. S. Kim et al 38p4d2f/8s4p2376.0676 Bakken et al Bakken et al. Cortez et al Energy/Ehp/D θ 74.966 71000 0.989 -75.586 .9 07.7 0967 1.92 100.3 0.990 -76.011 2.20 105.50 0.947 76.024 2.15106.0 0.943 76.027 .04 104.6 0.946 106.3 0.940 76.058 .99 106.00.941 76.06 93 6. 0.941 [6s5p2d/3slpl. 43-76.062 2.08 106.6 0.941 (5s4p2d/3slpsTo, 39 76.064 2.00 0.1 0.940 cc-pVQZ, 11576.0655 97 106.2 0.940 aug-cc-pVQZ, 172 -76.0667 94 1063 0.940 06.3 0.940 106.30.940 cc-pV5Z, 20-76.0678 96 06.33 0.9396 63+G(22p4776.057 2.02 cc-pVTZ, 58 aug-cc-pVTZ, 92 [8s6p4d2f/6s3pld 12 76.0675 194 aug-cc-pV5Z, 287 76.0680 94 6.340.9396 cc-pV6Z, 322-76.06810.95 06.34 0.9396 aug-cc-pV6Z, 443 -76.06815 .94 106.34 0.9396 Pahl, Handy Estimated Hartree-Fock ener Nonrelativistic fixed-nuclei energy Experimental values special 106.340.9396 76.06817 -76.068 -76.438 76.480 85 104.5 0.9578
Fantastic news! We've Found the answer you've been seeking!
Step by Step Answer:
Answer rating: 77% (9 reviews)
The HH distance R HH is found f...View the full answer
Answered By
Salmon ouma
I am a graduate of Maseno University, I graduated with a second class honors upper division in Business administration. I have assisted many students with their academic work during my years of tutoring. That has helped me build my experience as an academic writer. I am happy to tell you that many students have benefited from my work as a writer since my work is perfect, precise, and always submitted in due time. I am able to work under very minimal or no supervision at all and be able to beat deadlines.
I have high knowledge of essay writing skills. I am also well conversant with formatting styles such as Harvard, APA, MLA, and Chicago. All that combined with my knowledge in methods of data analysis such as regression analysis, hypothesis analysis, inductive approach, and deductive approach have enabled me to assist several college and university students across the world with their academic work such as essays, thesis writing, term paper, research project, and dissertation. I have managed to help students get their work done in good time due to my dedication to writing.
5.00+
4+ Reviews
16+ Question Solved
Related Book For
Question Posted:
Students also viewed these Mechanics questions
-
Write down the l = 2 portion of the matrix representative of in the basis.
-
The AM1 valence electronic energies of the atoms H and O are - 11.396 eV and -316.100 eV, respectively. For H2O at its AM1-calculated equilibrium geometry, the AM1 valence electronic energy...
-
Benzyne has long been implicated as an intermediate in nucleophilic aromatic substitution; for example, Although the geometry of benzyne has yet to be conclusively established, the results of a 13 C...
-
Create a class called Car that includes three instance variablesa model (type String), a year (type String), and a price (double). Provide a constructor that initializes the three instance variables....
-
Two routes are under consideration for a new interstate highway. The long intervalley route would be 25 kilometers in length and would have an initial cost of $25 million. The short transmountain...
-
The second law of thermodynamics helps to define (a) Heat (b) Work (c) Entropy (d) Internal energy
-
In general, what procedures does an auditor apply during the subsequent period to identify significant subsequent events?
-
On September 1, Howe Office Supply had an inventory of 30 calculators at a cost of $18 each. The company uses a perpetual inventory system. During September, the following transactions occurred....
-
You must include source reference citations in-text and a reference list of complete citations, in support of your essay. Failure to include references will result in loss of points. FACTS: Kadie,...
-
Complete Keith's tax return including all required schedules and forms using prince edward island as province, using the fillable forms package. Taxpayers Information Taxpayer #1 Name: Keith Dox...
-
For the function U = 3x2 + 6y2, (a) Locate the minimum by inspection; (b) Start at the point x = 9, y = 9 and apply the conjugate-gradient method to locate the minimum. Do the calculations by hand....
-
True or false? (a) All triatomic molecules are planar. (b) The distance matrix is a symmetric matrix. (c) The diagonal elements of the distance matrix are zero. (d) The Hessian is a symmetric matrix.
-
The partnership of Ali, Bev, and Cal became insolvent during 2011, and the partnership ledger shows the following balances after all partnership assets have been converted into cash and all available...
-
What is the value of number after the following statements execute? int number = 10; number 5; number -= 2; number *= 3;
-
0.056kg tennis ball is thrown straight up at a speed of 20/ms A. What is the ball's kinetic energy when it is thrown? B. What must be the ball's potential energy be when it reaches the top? C. How...
-
Given a CPU with the following specs: Uses 10 V Requires 49 W Has a clock rate of 13 Hz What is the capacitance? Round your answer to 2 decimal places
-
Determine the time complexity of the following algorithm, where n is the input size. (4 points) sum = 0 i = 1 for 1 to n do sum* = i end for j = i while <10 do j += 1 sum += j *= 2 end while
-
ABC Limited, is an exporter from UK. His receivables on account of exports to Canada are Can $ 5,00,000 which are due in 6 months. ABC wants to hedge is export receivable in Forward Market. The...
-
Charles Friend is an accountant and his wife, Monica, is a cook. They have four children. They also take care of Monicas mother, who lives with them. They had bank interest of $500 from Chase Bank...
-
United Business Forms capital structure is as follows: Debt ............................................ 35% Preferred stock ........................... 15 Common equity .......................... 50...
-
Studies of the relationship of the Sun to its galaxythe Milky Wayhave revealed that the Sun is located near the outer edge of the galactic disk, about 30 000 light-years from the center. The Sun has...
-
The oldest artificial satellite in orbit is Vanguard I, launched March 3, 1958. Its mass is 1.60 kg. In its initial orbit, its minimum distance from the center of the Earth was 7.02 Mm, and its speed...
-
Astronomers detect a distant meteoroid moving along a straight line that, if extended, would pass at a distance 3RE from the center of the Earth, where RE is the radius of the Earth. What minimum...
-
The prosecution intends to call ten witnesses during the trial. Based on your Virginia evidentiary rules and case law, discuss with Carl about the examination of witnesses, including the defense's...
-
On 1 January 2016, Tetra Bhd issued 1,000,000 convertible loan stock at face value of RM200,000,000. Transaction cost amount to RM2,000,000. The interest is payable at the end of each year over the...
-
List five (5) basic motivational factors identified inHerzberg's Two Factor Theory List five (5) hygiene factors identified inHerzberg's Two Factor Theory Why are motivational factors more effective...
Study smarter with the SolutionInn App