24
DCUMENTATION PAGE AD- A222 276 ==t'at' O OwO" a". OQ. ',wo -O lo 1= 1 1990 APRIL 16 I inal Report: 12/l/88-11130/89 &M AMa *Uo WW Luwus FUNDING umBEss "Purchase of a 200 MHz FT-NMR Spectrometer 61102F 2303/A3 6.AU HOASI Dr. Alan P. Marchand 7. uPtIOMINK ORGANIZATOf NAMAIS) AND AOORSS(IS) L. PtERfOR ORA NIZON Department of Chemistry 4~OO "JMSIR University of North Texas &, i.m 90 - 0 6 0 2 NT Station, Box 5068 Denton, TX 76203-5068 L. SPONSORING/ MOW00IIN AGENC NAME(S) AND A000=911S) 10. SPONamxgeMOWRoMm AFOSR/NC AGENo= MPOET UR Boiling AFB', Washington, D. C. 20332-6448 1.SUMPLIMNTARTF 40"Y9 s9' II& N OISrIS1OII AVAIJAUJ STATtMENT LIPIRS 0265RUT O Approved for public reease: Distribution is unlimite I& AMM M AIAJO@ ,1-e Chemistry Department, University of. North Texas, was gran- ted funds from AFOSR in the amount .fk $50,000 which was applied to the purchase of a Varian Gemini 200 high-field (200 (@z) Fourier transform (FT) nuclear magnetic resonanj (NMR) spectrometer. This routine instrument, used for observation of 1H and 13 C nuclei, has been used continuously since its arrival to improve the efficiency of currently funded DoD research that involves: i_,1isis of new high energy/high density solid and liqvid hydrocarbon fuels, (if synthesis of new energetic materials, and (iT~n thesis of isotopically labeled amines an~d organoammonium nitrate salts. These projects have received generous financial support from the U. S. Air Force and Army. In additiok S the avia4t f( i new NMR instrument has provided expanded opportunities for re- ,search on: (C4Y polysilylpolyynes and polysiloxyalkynes that are of in~prest as potenta new semiconductors, photoresists, and ceramic precursors and ic5 desr~gn and analysis of anionic polymerization initiators for the synthesis of improved elastomers. Finally, S the new 200 MHz NMR instrument has provided new opportunities for hands-on experience With high-field NMR for non-NMR spectroscopists, thereby affording important experience for the education and training of future chemists~ TTLiI NUBRof PAGES xc ea etic, Resonance Spectrometer ) tirC_ JS vnfty io S 22 I&~ PUG C001 17. QW CASOWTM ILSWMI OSOKAN I I OS MOA LUfAMO KWT'~B UO OpAIP4~ OP TISt PAGE CO ABSTSAW UL (unlimited) UNCLASSIFIED .UNCLASSIFIED UNCLASSIFIED SAR (same as reporg No $two"1 (t *MO -

AD- A222 276 APRIL I · and liqvid hydrocarbon fuels, (if synthesis of new energetic materials, and (iT~n thesis of isotopically labeled amines an~d organoammonium nitrate salts

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Page 1: AD- A222 276 APRIL I · and liqvid hydrocarbon fuels, (if synthesis of new energetic materials, and (iT~n thesis of isotopically labeled amines an~d organoammonium nitrate salts

DCUMENTATION PAGE

AD- A222 276 ==t'at' O OwO" a". OQ. ',wo -O lo 1=1 1990 APRIL 16 I inal Report: 12/l/88-11130/89

&M AMa *Uo WW Luwus FUNDING umBEss

"Purchase of a 200 MHz FT-NMR Spectrometer 61102F 2303/A3

6.AU HOASIDr. Alan P. Marchand

7. uPtIOMINK ORGANIZATOf NAMAIS) AND AOORSS(IS) L. PtERfOR ORA NIZONDepartment of Chemistry 4~OO "JMSIRUniversity of North Texas &, i.m 90 - 0 6 0 2NT Station, Box 5068Denton, TX 76203-5068

L. SPONSORING/ MOW00IIN AGENC NAME(S) AND A000=911S) 10. SPONamxgeMOWRoMmAFOSR/NC AGENo= MPOET URBoiling AFB', Washington, D. C. 20332-6448

1.SUMPLIMNTARTF 40"Y9 s9'

II& N OISrIS1OII AVAIJAUJ STATtMENT LIPIRS 0265RUT O

Approved for public reease: Distribution is unlimite

I& AMM M AIAJO@ ,1-e Chemistry Department, University of. North Texas, was gran-ted funds from AFOSR in the amount .fk $50,000 which was applied to the purchase of aVarian Gemini 200 high-field (200 (@z) Fourier transform (FT) nuclear magnetic resonanj(NMR) spectrometer. This routine instrument, used for observation of 1H and 13C nuclei,has been used continuously since its arrival to improve the efficiency of currentlyfunded DoD research that involves: i_,1isis of new high energy/high density solidand liqvid hydrocarbon fuels, (if synthesis of new energetic materials, and (iT~nthesis of isotopically labeled amines an~d organoammonium nitrate salts. These projectshave received generous financial support from the U. S. Air Force and Army. In additiok

S the avia4t f( i new NMR instrument has provided expanded opportunities for re-,search on: (C4Y polysilylpolyynes and polysiloxyalkynes that are of in~prest as potentanew semiconductors, photoresists, and ceramic precursors and ic5 desr~gn and analysiso f anionic polymerization initiators for the synthesis of improved elastomers. Finally,

S the new 200 MHz NMR instrument has provided new opportunities for hands-on experienceWith high-field NMR for non-NMR spectroscopists, thereby affording important experiencefor the education and training of future chemists~

TTLiI NUBRof PAGESxc ea etic, Resonance Spectrometer ) tirC_ JS vnfty io S 22

I&~ PUG C001

17. QW CASOWTM ILSWMI OSOKAN I I OS MOA LUfAMO KWT'~B UOOpAIP4~ OP TISt PAGE CO ABSTSAW UL (unlimited)

UNCLASSIFIED .UNCLASSIFIED UNCLASSIFIED SAR (same as reporg

No $two"1 (t *MO -

Page 2: AD- A222 276 APRIL I · and liqvid hydrocarbon fuels, (if synthesis of new energetic materials, and (iT~n thesis of isotopically labeled amines an~d organoammonium nitrate salts

COMPLETED PROJECT SUMMARY

TITLE: Purchase of a 200 MHz FT NMR Spectrometer

PRINCIPAL INVESTIGATOR: Professor Alan P. MarchandDepartment of ChemistryUniversity of North TexasDenton, TX 76203-5068

INCLUSIVE DATES: 1 December 1988 - 30 November 1989

CONTRACT/GRANT NUMBER: AFOSR-89-0109

COSTS AND FY SOURCE: $50,000, FY89

SENIOR RESEARCH PERSONNEL: Members of the Chemistry Faculty, Departmentof Chemistry, University of North Texas

JUNIOR RESEARCH PERSONNEL: Postdoctoral Research Associates and GraduateStudetns, Department of Chemistry, Universityof North Texas

ABSTRACT OF OBJECTIVES AND'ACCOMPLISHMENTS:

The Department of Chemistry, University of North Texas was granted funds from the AirForce Office of Scientific Research in the amount of $50,000 which was applied to thepurchase of a Varian "Gemini 200" high-field (200 MHz) Fourier transform nuclear mfgneticyssonance (FT-NMR) spectrometer. This routine instrument, used for observation of H andC nuclei, has been used continuously since its arrival to improve the efficiency of

currently funded DoD research that involves: (i) synthesis of new high energy/high densitysolid and liquid hydrocarbon fuels, (ii) synthesis of new energetic materials, and (iii)synthesis of isotopically labeled amines and organoammonium nitrate salts. These projectshave received generous financial support from the U. S. Air Force and the U. S. Army. Inaddition, the availability of this new NMR instrument has provided expanded opportunitiesfor research on: (i) polysilylpolyynes and polysiloxyalkynes that are of interest aspotential new semiconductors, photoresists, and ceramic precursors and (ii) design andanlysis of anionic polymerization initators for the synthesis of improved elastomers.Finally, the new 200 MHz NMR instrument has provided new opportunities for hands-onexperience with high-field NMR for non-NMR spectroscopists, thereby affording importantexperience for the education and training of future chemists.

Approved for public releaSedistribution unlimited.

Page 3: AD- A222 276 APRIL I · and liqvid hydrocarbon fuels, (if synthesis of new energetic materials, and (iT~n thesis of isotopically labeled amines an~d organoammonium nitrate salts

FINAL REPORT

"PURCHASE OF A 200 MHz FT-NMR SPECTROMETER"

AFOSR-89-0 109

Principal Investigator: Dr. Alan P. Marchand

Department of Chemistry, University of North Texas, Denton, TX 76203-5068

Date Submitted: April 16, 1990

The views, opinions, and/or findings contained in this report are those of the authors andshould not be construed as an official Department of the Air Force position, policy, ordecision, unless so designated by other documentation.

Accesion For

NTIS CRAW&IDWiC TAU

Uilajrour-ced 0JusitiCatil.-

ByDistribution I

Availability Codes

Avail ardlor

Dist soecial

Approved for public release:distribution unlimited.

Page 4: AD- A222 276 APRIL I · and liqvid hydrocarbon fuels, (if synthesis of new energetic materials, and (iT~n thesis of isotopically labeled amines an~d organoammonium nitrate salts

INTRODUCTION

The Department of Chemistry, University of North Texas was granted funds from the Air

Force Office of Scientific Research in the amount of $50,000 which was applied to the

purchase of a Varian "Gemini 200" high-field (200 MHz) Fourier transform nuclear magnetic

resonance (FT-NMR) spectrometer. This routine instrument, used for observation of IH and

13C nuclei, has been used continuously since its arrival to improve the efficiency of

currently funded DoD research that involves: (i) synthesis of new high energy/high density

solid and liquid hydrocarbon fuels, (ii) synthesis of new energetic materials, and (iii)

synthesis of isotopically labeled amines and organoammonium nitrate salts. These projects

have received generous financial support from the U. S. Air Force and the U. S. Army. In

addition, the availability of this new NMR instrument has provided expanded opportunities

for research on: (i) polysilylpolyynes and polysiloxyalkynes that are of interest as

potential new semiconductors, photoresists, and ceramic precursors and (ii) design and

anlysis of anionic polymerization initators for the synthesis of improved elastomers.

Finally, the new 200 MHz NMR instrument has provided new opportunities for hands-on

experience with high-field NMR for non-NMR spectroscopists, thereby affording important

experience for the education and training of future chemists.

Page 5: AD- A222 276 APRIL I · and liqvid hydrocarbon fuels, (if synthesis of new energetic materials, and (iT~n thesis of isotopically labeled amines an~d organoammonium nitrate salts

2

INSTRUMENT PURCHASE AND INSTRUMENT USE REPORTS

Purchase of the Varian Gemini 200 FT-NMR Spectrometer. The successful open market

bidder was Varian Associates, Inc., who provided the Gemini 200 FT-NMR spectrometer at a

total cost of $144,100.The non-automated open market purchase order (order no. 90524) is

appended (see APPENDIX I).

The necessary funds were provided by two sources: (i) Air Force grant no.

AFOSR-89-0109 ($50,000) and (ii) the State of Texas ($94,100). The instrument was

delivered to the Department of Chemistry, University of North Texas on June 21, 1989.

Subsequently, the instrument was installed by personnel from Varian Associates, and

delivery was accepted formally by the University on August 5, 1989.

Instrument Use Report. NMR use reports have been generated for three time periods:

(1) 8/5-31/89, (ii) 9/l/89-12/31/89, and (III) I/1/90-4/9/90 (see APPENDIX II). In these

reports, individual members of the Chemistry faculty are identified by name, and their use

of the Gemini 200 FT-NMR spectrometer is documented by total hours of instrument time used

during the specified time period and also as a percentage of total time available. It

should be noted that "productive time" during the period 9/1/89 through 4/9/90 exceeded

70/o cf total time available, and instrument downtime has been minimal during this period.

Finally, it should be noted that the use of the Gemini 200 FT-NMR spectrometer in

connection with Dr. Marchand's DoD funded research projects accounted for 1,212 hours of

the total 3,803.3 hours of productive instrument time. Thus, 31.9% of productive

instrument time has been devoted exclusively to DoD funded resea'ch projects since the

Gemini 200 NMR spectrometer was placed in service.

Page 6: AD- A222 276 APRIL I · and liqvid hydrocarbon fuels, (if synthesis of new energetic materials, and (iT~n thesis of isotopically labeled amines an~d organoammonium nitrate salts

APPENDIX I

Page 7: AD- A222 276 APRIL I · and liqvid hydrocarbon fuels, (if synthesis of new energetic materials, and (iT~n thesis of isotopically labeled amines an~d organoammonium nitrate salts

NON-AUTOMATED 14

OPEN MARKET PURCHASE ORDERSEE REVERSE SIDE FORINVOICING INSTRUCTIONS PREPAY ALL CHARGIES

_______________________________SHOW THESE NOS. ON ALLINVIOICE (IN OUINTUPLICATE) TO AGENCY BELOW ALL TERMS AND CONDITONS PAPERS AND PACKAGES

____ ___ ___ ____ ___ ___ ____ ___ ___ SET FORTH IN OUR 8ID

NORTH TEXAS STATE UNIVERITY OF AHI OME ORDER NO. 90524CONTROLLERS OFFICE REON NO. 752-9-07990-HP.O. BOX 13767, N.T. STATION ORDER DATE -5-5-89 -PG IDENTON, TEXAS 76203

VENOO' GUARANTEES MiER- VENDORDESTINAT)ON OF GOODS IF DIFFERENT FROM AWJE CHNDS OIVERED ON

THIS OAJM WL MEE IOR VID # 1-94-235-9345-800NORTH TEXAS STAtE UNIVERSITY SPCIIIPTIN IN VRINASCTEN.CENTRAL RECEIVING WAREHOUSE 611NVTTIN AN SNCWAT, D NC.2310 1 35E NORTH 61 HOAECUSOL ALO E WLO AY 940DENTON, TEXAS 76201FOAGNYUEOL PLOLTC 940

ITEM 490-.68 DESCRIPTION OUANTITY UNIT IUNIT PMiCE EXTENSION

INSTALLMENT PURCHASE

QUOTATION NO. -9-56DF-766. .

1. FOURIER TRANSFORM NUCLEAR MAGNETIC RESONACE I. SYS 144100.00 $144,100.00SPECTROMETER, TO MEET OR EXCEED THE FOLLOWING MIN.SPECS.:I.-SCOPE: THE SPECTROMETER SUPPLIED SHALL BE AN NMR

(NUCLEAR MAGNETIC REAONANCE) SPECTROMETER OPERATINGAT A FIELD STRENGTH OF 47.5 KILOGAUSS (KG) ANDCONSISTING OF THE FOLLOWING: OPERATING CONSOLEW/DATA SYSTEM, SUPERCONDUCTIVE MAGNET, VARIABLETEMPERATURE PROBE, SOFTWARE, MANUALS, AND ALLNECESSARY OPERATING SUPPLIES.

II. SYSTEM PERFORMANCE: THE SPECTROMETER SHALL BECAPABLE OF PRODUCING HIGH-QUALITY (1)H AND (13)CSPECTRA, BOTH FOR ROUTINE AND RESEARCH PURPOSES.THE SELLER SHALL FURNISH SUCH DATA AS NECESSARYTO ESTABLISH THE FOLLOWING PERFORMANCE MINIMUMS:A. FIELD STRENGTH

47.5 KG (SUPERCONDUCTING MAGNET W/51 MM BORE)B. FREQUENCY RANGE

1(H) OBSERVATION AT 200 MHZ(13)C OBERSERVATION AT 50 MHZ5 MM SWITCHABLE (1)H TO 13C

CONTT.NUED/s fh

FOB DESTINATION CASH DISCOUNT % ___DAYS

FAILURE TO DELIVER-it the contractor fails 1o definr these supplies by ftl pmised deh"er date or a reasoable limeherefer givng acceptable reasons lor delay or if supplies ao re 110,s~e 11011 blt t ~me specilncalons, the state IN ACCORDANCE VATH YUR BID PROPOSAL. SUPPLIES MUSTstarves 1he right to purchr speiie supplies elseehem. aOllg hMp maem Wich Iprice W4d cosl of handling, if "y. to BE PLACED IN THE DEPARTMENT RECEMVNCI ROOM IN'CCinfs comatr. No suflitutioris nor cancellations permitteid withou prie appr of flth Slat Purchsin d Genema 120 DAYS ARID DWS FROM RECEIPT OF ORDER

'ho Stae of Texas is empr from as Fede"a Excrae ase STATE PURCHASING ANDSTATE AND CITY SALES TAX EXEMPTION CERTIFICATE: The undersignied claims an smripr "m tax GENERAL. SERVICES COMMISSIONunit& Cheate 20, Tile 122A. Relio e Civi Swuse of Teem. 1w purchm Of gil personal property describe in thia numroidor. purchemed Irm cofirecto &%W slYe bd Gb asm11 pepert is bein secutw forthme oelusive use of the State By ______________________

Tf te PURCHASING DIVISIONAUSTIN. TEXAS 7niI

Page 8: AD- A222 276 APRIL I · and liqvid hydrocarbon fuels, (if synthesis of new energetic materials, and (iT~n thesis of isotopically labeled amines an~d organoammonium nitrate salts

STATE PURCHABING M GENERALSC-I.7) SERVICES COMMISSION 14

PURHASING ODIVISION • AUSTIN. TEXAS 1117L Po - of Pelf

Ud0OPq ding • 04-24 a,9

757 m0..7

Bidder MvstFitn hNW Oe VARIAN ASSOC. INCBidder ~ ~ Iae sells. ,.,..,

Iue% No It@& and Dmcrlptin GkAntity Unit Plke~oPl imit Price Extensir-- I I II I II- - - -

C. Resolution

o.2.z 1 (1% ODCE)0.2Hz 13(, (ASTM decoupled dioxane)30:1- I, 0.1% eothylbenzene, 5 m"switchable probe35:1 13C, 60% C6 D6 in dioxane, 5 unswitchable probe

All above capabilities to be availableon a single probe.

E. Spinning Sidebands

< 1% 1H, S mK 1% 13C, S M

F. Lineshape (Sm, IN)3' 10Hz linewidth at 0.55% amplitude leve

K 25Hz linewidth at 0.11% amplitude leve

G. Observe Pulse Power (900 Pulse)

35 microseconds, IN, 5 m:, 25 microseconds, 13C, 5 mm

H. Observe Offset Range

+ 50 kfz in 0.1 Hz steps

1. Decoupler Offset Range

+ 50 kHz in 0.1 Hz steps

J. Lock System

2H internal lock: minimumlock conce-tration of 25% CDCL 3 in 5 mmbroadband probes-

Computer controlled automatic locking

with 5 ppm capture range

K. Filters

3-pole Butterworth, 3 or 15 kHz fixed

Page 9: AD- A222 276 APRIL I · and liqvid hydrocarbon fuels, (if synthesis of new energetic materials, and (iT~n thesis of isotopically labeled amines an~d organoammonium nitrate salts

STATE PURCHASING A GENERALSERVICES COMMISSION" ¢"" '""

PURCHASING DIVISION • AUSTIN. TEXAS 18711 Poge - e1 4 polo,

, 04-24 89

, , , 7;7. 0 ,i/,- ur,

Sidd Mw in " 0 • VARIAN ASSOC INCBidderskf 0"d Fill in4 ,, ,,-, -I.' -,r u-o- '.''tam No Item and Oscrlition Quantity Unit U'kelWI It Price Extensic

L. A/D Converter

12 bit resolution; 25,000 sample pairs persecond sampling rate

M. Acquisition Time •

I millisecond to 100 seconds in 1 milli-second steps

N. Spectral Width

Up to 23 kHz with quadrature phase detection

.b. Variable Temperature

-1500C to +2000C, computer controlled

III. ANALOG AND RF SYSTEM

A. Magnet

1. 47.5 kG, fully persistent: nominalfield decay 0.1 ppm/hr IN

2. 51gu bore3. Low cryogenic loss design: boil off

rates (room temerature 20C):He0J.31 1/dayN2 ..2.S 1/day

4. Dewar capacity: 28 liters He35 liters N2

5. 80 day liquid He refill interval6. 14 day liquid N2 refill interval

B. Operating Console

The console must include the followingfeatures and facilities:

1. Lock, ovserve and decoupling frequentcieisynthesized from one master clock

2. Deuterium heteronuclear locka. Pulse interalb. Automatic lock

3. Observe RF systema. All frequencies to be derived from

one source in the broadband mode

Page 10: AD- A222 276 APRIL I · and liqvid hydrocarbon fuels, (if synthesis of new energetic materials, and (iT~n thesis of isotopically labeled amines an~d organoammonium nitrate salts

STATE PURCHAINO & UENERALCW4S) SERVICES COMMISSION Comaqs'ie"s

PURCHASING DIVISION • AUSTIN. TEXAS 7111 Pet 4.-....o ] 14 Pol,

I O3Mg 04-14 i89O.. *.uane I PU. 4-2

B., W Ms FU. inNn ."006 VARIAN ASSOC INC

It* Nob Item and Descrptlon .antity Unit rake/PbtunI it P.]. c xtensi

b. Selection of output frequency, RFamplifiers and filters to be auto-matic with observe nucleuS selection

c. Output gateable and phase shiftableby computer control

4. Spin decoupler frequency, phase, and gat-ing under computer control

S. Status lights on the front panel to moni-tor VT regulation,l and lock

6. Front panel indicators to show spin rate,VT temperature and N2 flow

7. Console automation including hardware andsoftware to perform these functions:

AutoshimAutomatic sample spinningAutomatic sample eject/loadingAutomatic selection of receiver gainAutolockAutophaseDigital decoupling

C. Probe

1. Tuneable through control rods accessibleat bottom of probe

2. Operator to be able to observe the tuningindicator while adjusting the probe

3. Probe removable without disturbing theupper sample guide and spinning mechanism

4. Built-in VT capability of -1500C to+2000C

5. Probe to include 2H internal lockcapability

D. System Utility and Environmental Requirements

1. Console lire voltage: 117 Vac, singlephase, 50/60 Hz

2. Power consumption: 1.5 kVA maximum3. Ambient temperature limits: 170C to 249C4. Relative humidity: 20% to 80% nonconden-

sing

Page 11: AD- A222 276 APRIL I · and liqvid hydrocarbon fuels, (if synthesis of new energetic materials, and (iT~n thesis of isotopically labeled amines an~d organoammonium nitrate salts

STATE PUICHAINO M WIENERALSc-(.S) SERVICES COMMISB ION " C-.,--9mo k

PURCHASING DIVISION AUSTIN, TEXAS 1711 p . .. 14 P,

04-24 ,,89

Umber3533

Sddm~v in=me*. Nom.a tmss VARIAN ASSOC INCm~~~lBide legless ,,,,

Ito. No Ite and Description antitv Unit IWMke/bdte II PIeto xtslc

IV. DATA SYSTEM REQUIREMENTS

A. General Type

Must be designed with two separate CPU'sort for data acquisition and one for dataprocessing. It must be possible to perforrany data vanipulation required whileaquisition is in prcgress.

B. Data System Secifications

The data system shall have as a minimum thefollowing charateristics and specifications

1. Host System

a. Computer

Independent CPU with 32 bit regis-ters and arithmetic operationsand 16 bit data transfer; 64K-bytes ROM; 1.25 M bytes RAM(direct addressing to 4M bytes);an industry-standard-bus systeminterconnect; I/O-channel ifter-face for peripheral control

b. System Bus

Industry standard 32 bit

c. Disk Interface

DMA controller to system bus tostandard bus

d. Interfaces

Two RS-232C serial ports foroptional printer/plotters; AASCIZcoded; asynchronous; one Centronicport

2. Acquisition System

a. Computer

Independent CPU with 32 bit

Page 12: AD- A222 276 APRIL I · and liqvid hydrocarbon fuels, (if synthesis of new energetic materials, and (iT~n thesis of isotopically labeled amines an~d organoammonium nitrate salts

STATE PURCHASINO GBENEPIALSC- ) SERVICiE COMMISSION

PURCHASING DIVISION AUSTIN. TUXAS 11111 -

Dl Oa ,, •, 04-24Dido learso |pi..1 =

Iidr M ustFUIn NOd @1 $1 VARIAN ASSOC INCli~~~~~~eore glosses m .. ,,,,

ltu NO Ite. and Description Qaentlty LhIt tke/IPbdI Unit Price Extenslic

registers and arithmetic operationsa , 16 bit data transfer; 64K-bytesROM; 256K-bytes RAM; an indusi.ry-standard-bus system interconnect;

I/O channel interface to pulse sequenccontroller

b. Data Table128K bytes RAM; 60K words (16 bit) or30K words (32 bit)

c. Data Acquisition processor32 bit sum to memory with scaling;200 X z rate

d. Pulse ControllerMultiplexed 36 bit pulse sequencecontroller with hardware timing; 100nanosecond resolution; hardware andsoftware; looping; unlimited steps

e. A/D Converter12-bit resolution

f. System BusIndustry standard, 32 bit

g. Disk InterfaceDMA controller

3. Standard Information Storage Systema. Hard Disks

Winchester disk storage, 20 M byteminimum;, second Winchester diskoptional

b. Fleyible Disk5 i,.4 inch flexible disk; double-sidedouble density; 1 M byte capacity

(640 k formatted)c. Disk Controller

To control up to two hard disks and onflexible disk

d. System BusIndustry standard; 8 bit data transfer

4. Operator Interface

a. CRT Display13 inch, 16 color raster scan display;

576 x 434 pixel resolutionShall come with table; 69" L x 38" Dx 28" H

b. Graphics ProcessorIndependent display processor for vect rto-graphics conversion; dedicated 128K

byte display-refresh memory

Page 13: AD- A222 276 APRIL I · and liqvid hydrocarbon fuels, (if synthesis of new energetic materials, and (iT~n thesis of isotopically labeled amines an~d organoammonium nitrate salts

STATE PURCMAUIND & WENERAL.9C-Is 7) SERVICES COMMISSION '_,

PUICHASING DIVISION - AUSTIN, TEXAS 11111 pep ..... e. | 4

**, ** * ~04-24 1,89

3*iuheI, u 7, el.J(

SWdqr MustF~in gaaa. M~ I98 2 VARIAN ASSOC INCliddNM 000 Fcon om 2 04...,..,

Item Hki Item and Dosriition Quantity unit tPlkeft0dlUi t PPpI. E,te an7

c. Keyboard65-key, solid state freestanding key-board with full ASCII character setand dedicated microprocessor controll r

d. User Assiqned KnobsFive continuous assignable display

controls for adjustment of FID, spectram

and integral display, phase, cursor

position, and threshold levels; shaft-encoded, dedicated microprocessor

controller

V. STAYJ.RD SOFTWAREThe following software shall be provided:

A. System Features

Operating system- File oriented- Disk-based- Concurrent PASCAL

Up to six concurrent operations- Plotting - Keyboard input- Printing - Knob input- Processing

Screen-based display- Numeric and/or alphanumeric i~forma ion- Independent memory- Screen refresh

Automatic queing- Plotting- Printing- Keyboard input

Nine independent experiments with file spacefor:

- Parameters

Maximum arrayed parameters: 3Total values per arrayed parametez: 18

- One or more FIDsTotal 18 x 18 x 18 ID FIDs

- One or more spectraEnter all information from keyboazFive programmable, continuouslyadjustable knobs

B. Data Storage and File ManipulationSave and retrieve FIDs including:

- 2D FIDs- Parameters and text file

Page 14: AD- A222 276 APRIL I · and liqvid hydrocarbon fuels, (if synthesis of new energetic materials, and (iT~n thesis of isotopically labeled amines an~d organoammonium nitrate salts

STATE PURCHAWIND A WINFAL-. AHRVICES COMMISSION'

PURCHASIN DIVISION • AUSTIN, TEXAS 7IIII Pep o 14.... Post

wO,. - -s- 04-24 1,8.9

dder Mut FA ;M- VARIAN ASSOC INC

Item No lt. .ind Dscrlpmtlmn I Utv tI t PrakefbI tPeIc £ tohsr

File-based data storage- Subdivision of files unlimited- Display file directories including

text information- Rename, delete, compress, and copy

files

- Perform digital display or printoutcontents of any file

C. Data System ToolsUser-definable MACRO commands containing

- Commands- Selection of parameters

Pulse sequence programmabilityFull screen-based text editor

D. Pulse Sequence Prorra ingUser-programmable, PASCAL-based pulse sequ nce

codesHardware control:

- Transmitter- Decoupler

- Receiver gating

- Transmitter and decoupler phases- Decoupler modulation- Decoupler power level

- Transmitter and decoupler frequenci sPASCAL statements

- Parameter-controlled branching- Looping- Decision aking- Delay or pulse caiculations

New parameters- Create and use- Names

Up to 6 lettersUser selectable

- Parameters include:Pulses Frequencies

Delays IntegersFlags Names

Time/pulse controller- Continuously reprogramned- No known limit on number of pulses,

delays or other eventsPhase cycling

- Computational ly-ba sed- Unlimited number of different cycle

Different pulsesUnlimited periodicity

Page 15: AD- A222 276 APRIL I · and liqvid hydrocarbon fuels, (if synthesis of new energetic materials, and (iT~n thesis of isotopically labeled amines an~d organoammonium nitrate salts

STATE PURCHAIN13 &Jc-t3.7) SERVICES COMMISBION

PURCHASING DIVISION • AUSTIN. TEXAS 71711 Peg. e. .__4 - Pef

Pd Opeias 0m4;

U -.U3,. 7. : :/'.:..

"am o $d:a::n: VARIAN ASSOC INC

Item No Item end Description -Quntity Unit fbkP/eIPdeI l ile IIP IrxtnI- - - -

Branching and looping- Transiet counter based- Different pulse sequence variants

selectable on different scansTime events

- Pulses, delays. etc.- Specifiable in 100 nsec increment

(200 nsec minimum)- Automatic removal of pulses and eve tsentered as zero

E. Data ProcessingFourier tranformation16-bit floating pointWeighting

Exponential (positive or negative)GaussianConvolution-differenceSingly or in combination

Display FID- Real or imaginary- Weighted or unweighted

Optimum resolution enhancement parameters- Computer estimated- ID and 2D experiments

Phasing- Manual- Rapid manual- Automatic

2D data- Single command transformation with rwithout weighting

- Symmetrization along diagonal ormedian

- "Rotationw by any angleIntegrals

- Up to 34 programmable integral resetpoints

- Remove alternate integrals from dis layto display integrals of resonance or ly

Linear and non-linear baseline correctionStacked or "white-washed" display mode

- Up to 18 ID spectra simultaneousonscreen

- Horizontal and vertical offset betwe nspectra:

Specified by user or chosen autom aicallyby computer

Text labelling of displayed spectra for out putto printer or plotter

Page 16: AD- A222 276 APRIL I · and liqvid hydrocarbon fuels, (if synthesis of new energetic materials, and (iT~n thesis of isotopically labeled amines an~d organoammonium nitrate salts

BTATIS PURCHAIND & WENERALB-.70) KERVICES COMMI8ION Cmf"i

PURCHASING DIVISION • AUSTIN. TEXAS 711 Pe, , of I Post'

I *,,,, 3PW.04-24 oo !..Doq~Io emmmao ,II Ci 1 p,-

gWdMuNVIF FW in ,, VARIAN ASSOC INC

Itemm and Descriptio sntItY Unit Ihlake/Iael uni t Psice Eten@ir

Plotting of up to 18 1D spectra vith a sin le.command

F. 2D Data Display and PlottingColor intensity maps

-15 colors- Each color represents power of two- Interactive display

Cursor-selection of individual traces fordisplay and plotting

Selected region expansionContour map

- User selectableNumber of contours (no limit)Contour spacingStacked or "white-washed" plots2D traces

- Manipulate with any 1D software asdescribed above

G. Printing and Display of InformationListings

- Parameters mnemonic or English-base- Line listings: Peak heights and.frequencies in Hz and PPM

- Integrals: Raw or normalized f9rmatText Display

- One-line, large-size, or full scree- Use for prompting or experiment set upassistance

Screen dump of graphics or alphanumerics

H. Analysis Conands- Automatic region selection- Find the largest integral in given

area- Find total integral of specified re ion- Read total number of lines in speci ied

region- Read height and frequency of lines

in a spectrum- High-order baseline correction

I. Macro Features- Arguments- Conditional statements- Return values to another macro- Looping

- Input parameter values

Page 17: AD- A222 276 APRIL I · and liqvid hydrocarbon fuels, (if synthesis of new energetic materials, and (iT~n thesis of isotopically labeled amines an~d organoammonium nitrate salts

STATE PURCHASIND A GENERAL.-,.-U SERVICIES COMMISSION c"maeoler

PURCHASING DIVISION • AUSTIN. TEXAS 18111 Peop - of .9 ./. Pos

00os ,,, P. 04-24 It_.euhllelelal | C.M. fj'P.

Bid~ w F ~ Nasda VARIAN ASSOC INCMaw MWFO in -- oing,@-_ _ _ _ _ __ _ _ _ _ 1m. Su e d .htb Iea..lllies "a Ite and Dheciptton aaedity it Pb/eftfunIt Pie Exteni

- Output results to screen, printer and/orplotter

- Mathematics with numbers and parameters

J. Macro Library--Sample Macros- 4nitialize paramnters- Automatic proton spectrum- Automatic carbon spectrum with signal -tc1ise testing

- 1-C signal-to-noise test-H signal-to-noise test-H COSY

- Automatic pulse width calibration- Automatic expansions of 1H spectrum- Vertical scale adjustment- Examine and reference THS

K. Software CompatibilityAll information stored on diskettes (FIDs,parameters, and text files) must be compati lewith and accessible to software on a VariarVXR-4000 stand alone data station

L. Software UpdatesCorrections to software releases will be ma efree of charge

VI. DATA SYSTEM OPTIONSSystem shall be capable of adding the follc wingoptions:

Additional memory2 Mbytes (3 Nbytes total memory inclu Lng

the standard 1 Mbyte memory board)Hard disks

One of the following disks may be adde :- 30 Mbyte Winchester disk- 80 Mbyte Winchester disk- 140 Mbyte Vinchester disk

Streaming Magnetic TapeStorage: Up to 16 Mbytes

ModemPS-232 interface for Racal-type modem

Page 18: AD- A222 276 APRIL I · and liqvid hydrocarbon fuels, (if synthesis of new energetic materials, and (iT~n thesis of isotopically labeled amines an~d organoammonium nitrate salts

BTATE PURCHASING A GENERALBRVICES COMMIUSION 14

PURCHASING DIVISION • AUSTIN. TKXAS 1711 Pep - 14 pop,

W O.,.* aos . 04-24

XWO eta ,It,Ueq.u=..... 9 Qf'y C)

i u .Mst F2 In __ lsd.o:::* VARIAN ASSOC INC=~lll OrNl Cm 6IWA 299lllll

1%.. NO Item and Oteiatin mentitv Unit I~kefildrln It Prtl £Euten. on

VIZ. DELIVERY AND INSTALLATION

Equipment shall be delivered, installed andset in place to create a turnkey system bymutual agreement with the ordering departmentDelivery shall be scheduled and coordinatedwith contact person listed below. Contactperson should also be contacted for siteinspection if applicable. No"tuthority isintended or implied that specifications maybe amended prior to bid opening without

• written approval of the State. Purchasing andGeneral Services Commission.

DELIVERY AND INSTALLATION LOCATION-University of North Texas, Chemistry Departmel tMasters Hall, Avenue C a Sycamore,Denton, Texas 76201.University's contact person: Ruthanne Thomas817-565-3545.

NOTE TO BIDDERS:INSTALLMENT PURCHASE INFORMATION:

Bid total is for a two year installmentpurchase plan for the equipment listed.The installment purchase payments shall bebillable with 68% to 71% due within thirtydays of equipment delivery, 12 % to 14% duewithin thirty days of equipment installation.Remaining principal or buy out price to bepaid after JanuarylS, 1990.

Bidder shall show installation and freight,deinstallation if applicable, the cash price,the installment payments, the time pricedifferential charged, and the amount savedshould the University of North Texas exercisethe early buy out (pay off balance) payment.

PAYMENT SCHEDULE:

A. Cash Price (Pricipal Balance) $144,100.00B. Time Price Differential of $ -0-C. Total Deferred Purchase Price $144.100.00

Page 19: AD- A222 276 APRIL I · and liqvid hydrocarbon fuels, (if synthesis of new energetic materials, and (iT~n thesis of isotopically labeled amines an~d organoammonium nitrate salts

STATE PURCHASING AND GENERAL SERVICES COMMISSIONuRMCH=,NG IyXoW - AWrrN, TexAS 7r-371 C4feni.onp~ _p 1 of 14 p p

Dow 5..uszs u 3 PM. 04-24 1,189

i~ "sas 752-9-07990-H

Biddr Must Fil In d sa, g . ..,.,.Bidde ,.,,,.$X VARIAN ASSOC INC

ham N06I aiend Dslpon MyiI Unk MaIelModel Unit Puice Exignslorn

First year installment payments:$100, Owthin thirty- days of equipment delivery.$7U0Oremaining principal balance (buy out price)

$19,100within thirty days of equipment installatio.

$25.00cremaining principal balance (buy out price)

Second year installation payment (final payment)to be paid within 30 days after January 15, 1990.$25 000kmount Due.

The University of North Texas will take cleartitle to the equipment upon the final installmentor early buy out (pay off balance) payment.

Note: The state retains the option of earlypurchase at anytime during the contract period,including at time of acceptance, by paying theoutright purchase price or the principal amountremaining as shown on the payment schedule withbuy out amount. There shall be no prepaymentpenalty. In the event funds are not appropriatedby the Texas Legislature for periodic paymentsfor the equipment included herein upon expirationof any future State Fiscal Year, the State ofTexas may cancel, without penalty, the netremainder payments for the equipment for whichno funds were appropriated by submitting tothe vendor 30 day prior written notice.

DE-INSTALLATION IF APPLICABLE:

Vendor shall be responsible to remove andtransport this equipment upon expiration ortermination of the installment purchase ifthe equipment is not purchased due to cancellationwithout penalty should the legislature fail toprovide appropriated funds for the equipmentlisted on the order. .Title to the machines andequipment, any replacement or additions, taxes,ect. shall remain the responsibility of thevendor until the installment period is terminatedor paid in full or until the early buy out (payoff balance) price is fully paid at which timethe State of Texas shall take clear title.

Page 20: AD- A222 276 APRIL I · and liqvid hydrocarbon fuels, (if synthesis of new energetic materials, and (iT~n thesis of isotopically labeled amines an~d organoammonium nitrate salts

[03-02-151 STATE PURCHASING AND GENERAL SERVICES COMMISSIONPURCHASING DIVISION - AUSTIN, TEXAS 78711-3047 Continuation

Page 1l.._ of 14.._ Pages

Bid Opening xxx,Date xxxxxxxxxx 3PM. 04-24 19 89

Requisition x xxxNumber xxxxxxx 752-9-07990-H

Bidder Must Fill In -- o Namoo xxx"x"Bidder xxxxxxxxx VARIAN ASSOC INC

(Return One Copy Unlees Otherwise Requested)

Item No Item and Description Quantity Unit MakelModel Unit Price Extension

VII. WARRANTY

WARRANTY FOR A PERIOD OF ONE YEAR TO INCLUDE ALLTRANSPORTATION, PARTS, LABOR AND FREIGHT CHARGESTO VENDORS CENTER IF REQUIRED.

REFERENCE: VARIAN GEMINI-200 FT-NMR

THIS CONTRACT IS SUBJECT TO CANCELLATION, WITHOUTPENALTY, EITHER IN WHOLE OR IN PART, IF FUNDS ARENOT APPROPRIATED.

POINT-OF-CONTACT:NAME: DAVE VEAPHONE: (800) 231-8134

LS/sfh

Page 21: AD- A222 276 APRIL I · and liqvid hydrocarbon fuels, (if synthesis of new energetic materials, and (iT~n thesis of isotopically labeled amines an~d organoammonium nitrate salts

APPENDIX Il

Page 22: AD- A222 276 APRIL I · and liqvid hydrocarbon fuels, (if synthesis of new energetic materials, and (iT~n thesis of isotopically labeled amines an~d organoammonium nitrate salts

SUIMMER 1989 UNT NMR USE REPORT

August 5, 1989 to August 31, 1989

Gemini-200 Oemini-200 Omini-200 TOTALS

w/o oper Percent with oper Percent Total Percent

Brady 0.00 O.OO 0.00 0.001 0.00 0.00

Conlin 0.00 0.00 2.00 0.31X 2.00 0.31%

Cook (blochem) 0.00 0.001 0.00 0.00 0.00 0.00%

Dobson 0.0O0 0. 00% 0.0O0 0.00%1 0.0O0 0.0OO%

Jones 0.00 0.00 0.00 0.00 0.00 0.001

Marchand 4.00 0.62% 18.00 2.78% 22.00 3.401

Marshal1/ 0.00 0.001

Jacobson 0.00 0.00% 0.00 O.OO

Richmond 0.00 0.00% 0.00 0.00% 0.00 0.001

Schwartz 0.00 0.00 0.00 0.00 0.00 0.001

Thomas 5.00 0.77% 0.00 0.001 5.00 0.77%

Training 0.00 O.OO 0.00 0.001 0.00 0.00

Productive Time 9.00 1.391 20.00 3.09% 29.00 4.48%

Maintenance 1.00 0.151

Idle 618.00 95.373

Downtime 0.00 0.00

Unaccounted for 0.00 0.001

Non-productive time 619.00 95.521

TOTAL 648.00 100.001

Page 23: AD- A222 276 APRIL I · and liqvid hydrocarbon fuels, (if synthesis of new energetic materials, and (iT~n thesis of isotopically labeled amines an~d organoammonium nitrate salts

GEMINI-200

FALL 1989 UNT NMR USE REPORT

September 1, 1989 to Decembber 31, 1989

rAuini-200 Gemtni-200 Geminl-200 TOTALS

w/o oper Percent with oper Percent Total Percent

Brady 0.00 0.00% 0.00 O. 00 0.00 O.OO

Braterman 0.00 0.00% 24.30 0.83% 24.30 0.83%

Conlin 978.60 33.42% 0.00 0.00K 978.60 33.42%

Cook (biochem) 0.00 0.00 0.00 0.00K 0.00 0.00

Dobson 0.00 O.OOK 0.00 0.00K 0.00 0.00

Jones 0.00 O.OOZ 0.00 O.OOK 0.00 0.00K

Marchand 689.80 23.56% 0.00 0.00K 689.80 23.56K

Marsha 1l/

Jacobson 0.00 0.00% 0.00 0.00K 0.00 0.00K

Norton 0.00 0.00% 0.50 0.02% 0.50 0.02%

Richmond 8.50 0.29% 0.00 0.00K 8.50 0.29%

Schwartz 287.00 9.80X 0.00 0.00K 287.00 9.80K

Thomas 83.90 2.18K 0.00 0.00% 63.90 2.18K

Training 29.10 0.99% 5.00 0.17K 34.10 1.16x

NMR Class (5620) 19.60 0.87K

Productive Time 2056.90 70.25% 29.80 1.02K 2086.70 71.27K

Hai ntenance 2.50 0.09K

Idle 0.00 0.00

Downtime 0.00 0.00K

Unaccounted for 838.80 28.65%

Non-productive time 841.30 28.73%

TOTAL 2928.00 100.00

Page 24: AD- A222 276 APRIL I · and liqvid hydrocarbon fuels, (if synthesis of new energetic materials, and (iT~n thesis of isotopically labeled amines an~d organoammonium nitrate salts

GEMINI-200

SPRING 1990 UNT NMR USE REPORT

January 1, 1990 to April 9, 1990

Gemini-200 Gemini-200 Gemini-200 TOTALS

w/o oper Percent with oper Percent Total Percent

Brady 9.50 0.431 0.00 0.001 9.50 0.431

Braterman 0.00 0.00 0.00 0.001 0.00 0.001

Conlin 626.10 28.671 0.00 0.001 626.10 28.671

Cook (blochem) 0.00 0.00 0.00 0.001 0.00 0.00

Dobson 0.00 0.001 0.00 0.001 0.00 0.001

Jones 0.00 0.001 0.00 0.001 0.00 0.001

Marchand 500.20 22.901 0.00 0.00 500.20 22.901

Marshall/

Jacobson 0.00 0.001 0.00 0.00 0.00 0.001

Norton 0.00 0.001 0.00 0.00

Richmond 116.20 5.321 0.00 0.001 116.20 5.321

Schwartz 418.00 19.141 0.00 0.001 418.00 19.141

Thomas 13.80 0.631 0.00 0.001 13.80 0.631

Training 0.00 0.001 3.80 0.171 3.80 0.171

Productive Time 1683.80 77.101 3.80 0.171 1687.60 77.271

Maintenance 0.00 0.00

Idle 0.00 0.00%

Downtime 4.00 0.181

Unaccounted for 492.40 22.551

Non-productive time 496.40 22.731

3U333UZ~U3ZZU3UZ

TOTAL 2184.00 100.001