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1

Molecular orbital theory of the electronic structure of organic compounds. III. Ab initio studies of charge distribution using a minimal Slater-type basis

Hehre, Warren J., Pople, John A.

Journal:

Journal of the American Chemical Society

Year:

1970

Language:

english

File:

PDF, 695 KB

english, 1970

2

The site of protonation in aniline

Pollack, Steven K., Devlin, John L., Summerhays, Kim D., Taft, Robert W., Hehre, Warren J.

Journal:

Journal of the American Chemical Society

Year:

1977

Language:

english

File:

PDF, 257 KB

english, 1977

3

Molecular orbital theory of the electronic structure of organic compounds. V. Molecular theory of bond separation

Hehre, Warren J., Ditchfield, R., Radom, L., Pople, John A.

Journal:

Journal of the American Chemical Society

Year:

1970

Language:

english

File:

PDF, 685 KB

english, 1970

4

Isotope effects on gas phase reaction processes. I. The determination of equilibrium isotope effects by ion cyclotron resonance spectroscopy

Wolf, J. Frederick, Devlin, John L, Taft, Robert W., Wolfsberg, Max, Hehre, Warren J.

Journal:

Journal of the American Chemical Society

Year:

1976

Language:

english

File:

PDF, 403 KB

english, 1976

5

Computation of electron repulsion integrals involving contracted Gaussian basis functions

John A Pople, Warren J Hehre

Journal:

Journal of Computational Physics

Year:

1978

Language:

english

File:

PDF, 460 KB

english, 1978

6

Self-consistent molecular-orbital methods. 22. Small split-valence basis sets for second-row elements

Gordon, Mark S., Binkley, J. Stephen, Pople, John A., Pietro, William J., Hehre, Warren J.

Journal:

Journal of the American Chemical Society

Year:

1982

Language:

english

File:

PDF, 793 KB

english, 1982

7

Self-consistent molecular orbital methods. 21. Small split-valence basis sets for first-row elements

Binkley, J. Stephen, Pople, John A., Hehre, Warren J.

Journal:

Journal of the American Chemical Society

Year:

1980

Language:

english

File:

PDF, 977 KB

english, 1980

8

Molecular orbital theory of the electronic structure of organic compounds. VII. Systematic study of energies, conformations, and bond interactions

Pople, John A., Radom, Leo, Hehre, Warren J.

Journal:

Journal of the American Chemical Society

Year:

1971

Language:

english

File:

PDF, 1.22 MB

english, 1971

9

Strong conformational consequences of hyperconjugation

Hoffmann, Roald, Radom, Leo, Pople, John A., Schleyer, Paul v. R., Hehre, Warren J., Salem, Lionel

Journal:

Journal of the American Chemical Society

Year:

1972

Language:

english

File:

PDF, 366 KB

english, 1972

10

In support of anionic hyperconjugation. The versatile methyl group

DeFrees, Douglas J., Bartmess, John E., Kim, Jhong K., McIver, Robert T., Hehre, Warren J.

Journal:

Journal of the American Chemical Society

Year:

1977

Language:

english

File:

PDF, 299 KB

english, 1977

11

Prevalence and nonrandom distribution of exonic mutations in interferon regulatory factor 6 in 307 families with Van der Woude syndrome and 37 families with popliteal pterygium syndrome

de Lima, Renata L L Ferreira, Hoper, Sarah A, Ghassibe, Michella, Cooper, Margaret E, Rorick, Nicholas K, Kondo, Shinji, Katz, Lori, Marazita, Mary L, Compton, John, Bale, Sherri, Hehr, Ute, Dixon, Mi

Journal:

Genetics in Medicine

Year:

2009

Language:

english

File:

PDF, 1.44 MB

english, 2009

12

Lake Breezes and Summer Rainfall

Jay R. Harman and John G. Hehr

Journal:

Annals of the Association of American Geographers

Year:

1972

Language:

english

File:

PDF, 1.65 MB

english, 1972

13

Long tree-rings

STAHLE, DAVID W., CLEAVELAND, MALCOLM K., HEHR, JOHN G., BRIFFA, KEITH R.

Journal:

Year:

1990

File:

PDF, 128 KB

1990

14

Torsional potentials of methyl rotors attached to polar linkages

Hehre, Warren J., Pople, John A., Devaquet, Alain J. P.

Journal:

Journal of the American Chemical Society

Year:

1976

Language:

english

File:

PDF, 589 KB

english, 1976

15

Transition state structures for the hydrolysis of α-D-glucopyranosyl fluoride by retaining and inverting reactions of glycosylases.

Tanaka, Yoshimasa, Tao, Wen, Blanchard, John S., Hehre, Edward J.

Journal:

Journal of Biological Chemistry

Year:

1995

File:

PDF, 29 KB

1995

16

etiologic aspects of failure of continuous lumbar peribural anesthesia

HEHRE, FREDERICK W., SAYIG, JOHN M., LOWMAN, ROBERT M.

Journal:

Anesthesia & Analgesia

Year:

1960

Language:

english

File:

PDF, 3.82 MB

english, 1960

17

LAKE BREEZES AND SUMMER RAINFALL

JAY R. HARMAN, JOHN G. HEHR

Journal:

Annals of the Association of American Geographers

Year:

1972

Language:

english

File:

PDF, 1.01 MB

english, 1972

18

Dendroclimatic Relationships of Post Oak Across a Precipitation Gradient in the Southcentral United States

David W. Stahle, John G. Hehr

Journal:

Annals of the Association of American Geographers

Year:

1984

Language:

english

File:

PDF, 1017 KB

english, 1984

19

Correlation of STO-3G calculated substituent effects on the proton affinity of benzene with .sigma.+ parameters

McKelvey, John M., Alexandratos, Spiro, Streitwieser, Andrew, Abboud, Jose L. M., Hehre, Warren J.

Journal:

Journal of the American Chemical Society

Year:

1976

Language:

english

File:

PDF, 379 KB

english, 1976

20

Effect of electron correlation on atomic electron populations

Carpenter, John E., McGrath, Mark P., Hehre, Warren J.

Journal:

Journal of the American Chemical Society

Year:

1989

Language:

english

File:

PDF, 363 KB

english, 1989

21

EFFECT OF EPINEPHRINE ON ONSET OF ANESTHETIC ACTION OF LIDOCAINE IN THE PERIDURAL SPACE IN MAN

SAYIG, JOHN M., HEHRE, FREDERICK W.

Journal:

Anesthesia & Analgesia

Year:

1959

Language:

english

File:

PDF, 902 KB

english, 1959

22

ChemInform Abstract: ALKYL SUBSTITUENT EFFECTS ON THE STABILITY OF PROTONATED BENZENE

HEHRE, WARREN J., MCIVER, ROBERT T. JUN., POPLE, JOHN A., SCHLEYER, PAUL VON R.

Journal:

Chemischer Informationsdienst

Year:

1975

File:

PDF, 104 KB

1975

23

Hydrolysis of α- and β-d-glucosyl fluoride by individual glucosidases: new evidence for separately controlled “plastic” and “conserved” phases in glycosylase catalysis

Hirokazu Matsui, Yoshimasa Tanaka, Curtis F. Brewer, John S. Blanchard, Edward J. Hehre

Journal:

Carbohydrate Research

Year:

1993

Language:

english

File:

PDF, 829 KB

english, 1993

24

Molecular orbital theory of the electronic structure of organic compounds. XXVI. Geometries, energies and polarities of C4 hydrocarbons

Hehre, Warren J., Pople, John A.

Journal:

Journal of the American Chemical Society

Year:

1975

Language:

english

File:

PDF, 1.60 MB

english, 1975

25

Dendroclimatic Relationships of Post Oak across a Precipitation Gradient in the Southcentral United States

David W. Stahle and John G. Hehr

Journal:

Annals of the Association of American Geographers

Year:

1984

Language:

english

File:

PDF, 1.43 MB

english, 1984

26

Effect of Cyclooxygenase Inhibition on Retinal and Choroidal Blood Flow during Hypercarbia in Newborn Piglets

Stiris, Tom, Suguihara, Cleide, Hehre, Dorothy, Goldberg, Ronald N, Flynn, John, Bancalari, Eduardo

Journal:

Pediatric Research

Year:

1992

Language:

english

File:

PDF, 511 KB

english, 1992

27

Integrating Fiber Optic Strain Sensors into Metal Using Ultrasonic Additive Manufacturing

Hehr, Adam, Norfolk, Mark, Wenning, Justin, Sheridan, John, Leser, Paul, Leser, Patrick, Newman, John A.

Journal:

Year:

2017

Language:

english

File:

PDF, 1.22 MB

english, 2017

28

ChemInform Abstract: ISOTOPE EFFECTS ON GAS PHASE REACTION PROCESSES. I. THE DETERMINATION OF EQUILIBRIUM ISOTOPE EFFECTS BY ION CYCLOTRON RESONANCE SPECTROSCOPY

WOLF, J. FREDRICK, DEVLIN, JOHN L. III, TAFT, ROBERT W., WOLFSBERG, MAX, HEHRE, WARREN J.

Journal:

Chemischer Informationsdienst

Year:

1976

File:

PDF, 96 KB

1976

29

Geometrical preferences of the crotyl anion, radical and cation

Paul v.R. Schleyer, James D. Dill, John A. Pople, Warren J. Hehre

Journal:

Year:

1977

Language:

english

File:

PDF, 461 KB

english, 1977

30

Orbital interaction in amino-ketones

Levin, Charles C., Hoffmann, Roald, Hehre, Warren J., Hudec, John

Journal:

Journal of the Chemical Society Perkin Transactions 2

Year:

1973

Language:

english

File:

PDF, 1.19 MB

english, 1973

31

Gas phase acidities of the 2-butenes. The use of organometallics as models for free carbanions

Bartmess, John E., Hehre, Warren J., McIver, Robert T., Overman, Larry E.

Journal:

Journal of the American Chemical Society

Year:

1977

Language:

english

File:

PDF, 285 KB

english, 1977

32

The Effect of Escherichia coli Endotoxin Infusion on the Ventilatory Response to Hypoxia in Unanesthetized Newborn Piglets

McDeigan, Gwendolyn E, Ladino, John, Hehre, Dorothy, Devia, Carlos, Bancalari, Eduardo, Suguihara, Cleide

Journal:

Pediatric Research

Year:

2003

Language:

english

File:

PDF, 138 KB

english, 2003

33

ChemInform Abstract: STARKER EINFLUSS DER HYPERKONJUGATION AUF DIE KONFORM.

HOFFMAN, ROALD, RADOM, LEO, POPLE, JOHN A., R. SCHLEYER, PAUL VON, HEHRE, WARREN J., SALEM, LIONEL

Journal:

Chemischer Informationsdienst

Year:

1972

File:

PDF, 108 KB

1972

34

ChemInform Abstract: MOLECULAR ORBITAL THEORY OF THE ELECTRONIC STRUCTURE OF ORGANIC COMPOUNDS. XXVI. GEOMETRIES, ENERGIES AND POLARITIES OF C4 HYDROCARBONS

HEHRE, WARREN J., POPLE, JOHN A.

Journal:

Chemischer Informationsdienst

Year:

1976

File:

PDF, 95 KB

1976

35

ChemInform Abstract: MO-BERECHNUNGEN AN CARBONIUMIONEN 3. MITT. BARRIEREN IN AETHYLKATIONEN

WILLIAMS, JAMES E. JUN., BUSS, VOLKER, ALLEN, LELAND C., R. SCHLEYER, PAUL VON, LATHAN, WILLIAM A., HEHRE, WARREN J., POPLE, JOHN A.

Journal:

Chemischer Informationsdienst. Organische Chemie

Year:

1970

File:

PDF, 132 KB

1970

36

Effects of a Nebulized NONOate, DPTA/NO, on Group B Streptococcus–Induced Pulmonary Hypertension in Newborn Piglets

Dabrowska, Katarzyna, Hehre, Dorothy, Young, Karen C, Navarette, Cristina, Ladino, John F, Bancalari, Eduardo, Suguihara, Cleide

Journal:

Pediatric Research

Year:

2005

Language:

english

File:

PDF, 374 KB

english, 2005

37

Molecular orbital theory of the electronic structure of organic compounds. XVII. Internal rotation in 1,2-disubstituted ethanes

Radom, Leo., Lathan, William A., Hehre, Warren J., Pople, John A.

Journal:

Journal of the American Chemical Society

Year:

1973

Language:

english

File:

PDF, 656 KB

english, 1973

38

Effect of metal complexation on the gas-phase acidities of alkylbenzenes

Kahn, Scott D., Hehre, Warren J., Bartmess, John E., Caldwell, Gary

Journal:

Organometallics

Year:

1984

Language:

english

File:

PDF, 695 KB

english, 1984

39

Inversion barriers in para-substituted anilines from ab initio molecular orbital theory

Hehre, Warren J., Radom, Leo, Pople, John A.

Journal:

Journal of the Chemical Society Chemical Communications

Year:

1972

Language:

english

File:

PDF, 202 KB

english, 1972

40

ANESTHETIC CONSIDERATIONS FOR COMPLICATED OBSTETRICS

DANIELS, JOHN C., HEHRE, FREDERICK W., Fischer, Diana B., Miller, Irving

Journal:

Anesthesia & Analgesia

Year:

1967

Language:

english

File:

PDF, 1.10 MB

english, 1967

41

Malignant Hyperthermia with Disseminated lntravascular Coagulation During General Anesthesia

DANIELS, JOHN C., POLAYES, IRVING M., VILLAR, ROMULO, HEHRE, FREDERICK W.

Journal:

Anesthesia & Analgesia

Year:

1969

Language:

english

File:

PDF, 568 KB

english, 1969

42

Continuous lumbar peridural anesthesia in obstetrics

Hehre, Frederick W., Sayig, John M.

Journal:

American Journal of Obstetrics and Gynecology

Year:

1960

Language:

english

File:

PDF, 700 KB

english, 1960

43

ChemInform Abstract: MO-THEORIE DER ELEKTRONENSTRUKTUR VON ORGANISCHEN VERBINDUNGEN 12. MITT. KONFORM., STABILITAETEN UND LADUNGSVERTEILUNGEN VON 35 MONOSUBSTITUIERTEN BENZOLEN

HEHRE, WARREN J., RADOM, LEO, POPLE, JOHN A.

Journal:

Chemischer Informationsdienst

Year:

1972

File:

PDF, 107 KB

1972

44

The Effect of a Nebulized NO Donor, DPTA/NO, on Acute Hypoxic Pulmonary Hypertension in Newborn Piglets

Young, Karen C., Ladino, John, Navarrete, Cristina, Dabrowska, Katarzyna, Hehre, Dorothy, Bancalari, Eduardo, Suguihara, Cleide

Journal:

Biology of the Neonate

Year:

2004

Language:

english

File:

PDF, 128 KB

english, 2004

45

ChemInform Abstract: MO-THEORIE DER ELEKTRONENSTRUKTUR VON ORGANISCHEN VERBINDUNGEN 13. MITT. FOURIER-KOMPONENTEN-ANALYSE VON POTENTIALFUNKTIONEN DER INNEREN ROTATION IN GESAETTIGTEN MOLEKUELEN

RADOM, LEO, HEHRE, WARREN J., POPLE, JOHN A.

Journal:

Chemischer Informationsdienst

Year:

1972

File:

PDF, 113 KB

1972

46

ChemInform Abstract: CORRELATION OF STO-3G CALCULATED SUBSTITUENT EFFECTS ON THE PROTON AFFINITY OF BENZENE WITH Σ+ PARAMETERS

MCKELVEY, JOHN M., ALEXANDRATOS, SPIRO, STREITWIESER, ANDREW JUN., ABBOUD, JOSE-LUIS M., HEHRE, WARREN J.

Journal:

Chemischer Informationsdienst

Year:

1976

File:

PDF, 95 KB

1976

47

ChemInform Abstract: ORBITAL-WECHSELWIRKUNG BEI AMINO-KETONEN

LEVIN, CHARLES C., HOFFMANN, ROALD, HEHRE, WARREN J., HUDEC, JOHN

Journal:

Chemischer Informationsdienst

Year:

1973

File:

PDF, 95 KB

1973

48

Molecular orbital theory of the electronic structure of organic compounds. XIII. Fourier component analysis of internal rotation potential functions in saturated molecules

Radom, Leo, Hehre, Warren J., Pople, John A.

Journal:

Journal of the American Chemical Society

Year:

1972

Language:

english

File:

PDF, 994 KB

english, 1972

49

Selection of configurations for parameterization of two-body interaction potentials

Carpenter, John E., Yets, Willis T., Carpenter, Ilene Locker., Hehre, Warren J.

Journal:

Journal of Physical Chemistry

Year:

1990

Language:

english

File:

PDF, 616 KB

english, 1990

50

SPIE Proceedings [SPIE SPIE Smart Structures and Materials + Nondestructive Evaluation and Health Monitoring - Las Vegas, Nevada, United States (Sunday 20 March 2016)] Sensors and Smart Structures Technologies for Civil, Mechanical, and Aerospace Systems 2016 - Characterization of embedded fiber optic strain sensors into metallic structures via ultrasonic additive manufacturing

Lynch, Jerome P., Schomer, John J., Hehr, Adam J., Dapino, Marcelo J.

Year:

2016

Language:

english

File:

PDF, 2.50 MB

english, 2016

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