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51

Theoretical confirmation of a 4Δ ground state for FeH

Charles W. Bauschlicher Jr., Stephen R. Langhoff

Journal:

Chemical Physics Letters

Year:

1988

Language:

english

File:

PDF, 532 KB

english, 1988

52

On the interpretation of the photoelectron spectrum of NiCO−

Charles W. Bauschlicher Jr., Leslie A. Barnes, Stephen R. Langhoff

Journal:

Chemical Physics Letters

Year:

1988

Language:

english

File:

PDF, 522 KB

english, 1988

53

Theoretical study of the bonding in LaFe2+, LaRu2+ and YRu2+

Charles W. Bauschlicher Jr., Stephen R. Langhoff

Journal:

Chemical Physics Letters

Year:

1989

Language:

english

File:

PDF, 390 KB

english, 1989

54

A theoretical determination of the radiative lifetimes of the A 2Σ+ and B 2Δ states of CF

Alistair P. Rendell, Charles W. Bauschlicher Jr., Stephen R. Langhoff

Journal:

Chemical Physics Letters

Year:

1989

Language:

english

File:

PDF, 435 KB

english, 1989

55

On the bonding in Mn2+

Charles W. Bauschlicher Jr.

Journal:

Chemical Physics Letters

Year:

1989

Language:

english

File:

PDF, 410 KB

english, 1989

56

On the electron affinity of Au3

Charles W. Bauschlicher Jr.

Journal:

Chemical Physics Letters

Year:

1989

Language:

english

File:

PDF, 369 KB

english, 1989

57

On the electron affinities of the Ca, Sc, Ti and Y atoms

Charles W. Bauschlicher Jr., Stephen R. Langhoff, Peter R. Taylor

Journal:

Chemical Physics Letters

Year:

1989

Language:

english

File:

PDF, 397 KB

english, 1989

58

On the bonding in Be22+

Charles W. Bauschlicher jr., Marzio Rosi

Journal:

Chemical Physics Letters

Year:

1989

Language:

english

File:

PDF, 259 KB

english, 1989

59

Theoretical study of the CH bond dissociation energy of acetylene

Charles W. Bauschlicher Jr., Stephen R. Langhoff, Peter R. Taylor

Journal:

Chemical Physics Letters

Year:

1990

Language:

english

File:

PDF, 612 KB

english, 1990

60

Theoretical study of the CH bond dissociation energy of C2H

Charles W. Bauschlicher Jr., Stephen R. Langhoff

Journal:

Chemical Physics Letters

Year:

1990

Language:

english

File:

PDF, 381 KB

english, 1990

61

Comparison of the bonding between ML+ and ML2+ (M=metal, L=noble gas)

Charles W. Bauschlicher Jr., Harry Partridge, Stephen R. Langhoff

Journal:

Chemical Physics Letters

Year:

1990

Language:

english

File:

PDF, 392 KB

english, 1990

62

Theoretical study of the positive ions of the dimers and trimers of the group IB metals (Cu, Ag, and Au)

Harry Partridge, Charles W. Bauschlicher Jr., Stephen R. Langhoff

Journal:

Chemical Physics Letters

Year:

1990

Language:

english

File:

PDF, 458 KB

english, 1990

63

Addendum to “on the bonding in Be22+”

Charles W. Bauschlicher Jr., Marzio Rosi

Journal:

Chemical Physics Letters

Year:

1990

Language:

english

File:

PDF, 114 KB

english, 1990

64

Radiative lifetimes for the X 1Σ+ state of NO+

Harry Partridge, Stephen R. Langhoff, Charles W. Bauschlicher Jr.

Journal:

Chemical Physics Letters

Year:

1990

Language:

english

File:

PDF, 329 KB

english, 1990

65

On the bonding of La+ and La2+ to C2H2, C2H4, and C3H6

Marzio Rosi, Charles W. Bauschlicher Jr.

Journal:

Chemical Physics Letters

Year:

1990

Language:

english

File:

PDF, 556 KB

english, 1990

66

The computation of CC and NN bond dissociation energies for singly, doubly, and triply bonded systems

Stephen R. Langhoff, Charles W. Bauschlicher Jr., Peter R. Taylor

Journal:

Chemical Physics Letters

Year:

1991

Language:

english

File:

PDF, 623 KB

english, 1991

67

Theoretical study of the CH bond dissociation energies of CH4, C2H2, C2H4, and H2C2O

Charles W. Bauschlicher Jr., Stephen R. Langhoff

Journal:

Chemical Physics Letters

Year:

1991

Language:

english

File:

PDF, 554 KB

english, 1991

68

Mg+ligand binding energies

Charles W. Bauschlicher Jr., Harry Partridge

Journal:

Chemical Physics Letters

Year:

1991

Language:

english

File:

PDF, 493 KB

english, 1991

69

The 2Σ+−2Π separation in KO

Charles W. Bauschlicher Jr., Harry Partridge, Kenneth G. Dyall

Journal:

Chemical Physics Letters

Year:

1992

Language:

english

File:

PDF, 373 KB

english, 1992

70

The photoelectron spectroscopy of NiCl2

Charles W. Bauschlicher Jr.

Journal:

Chemical Physics Letters

Year:

1992

Language:

english

File:

PDF, 476 KB

english, 1992

71

A theoretical study of Mg(CO2)+n and Sr(CO2)+n for n = 1 and 2 and Mg2CO+2

Mariona Sodupe, Charles W. Bauschlicher Jr., Harry Partridge

Journal:

Chemical Physics Letters

Year:

1992

Language:

english

File:

PDF, 783 KB

english, 1992

72

Theoretical study of the bond dissociation energies of propyne (C3H4)

Charles W. Bauschlicher Jr., Stephen R. Langhoff

Journal:

Chemical Physics Letters

Year:

1992

Language:

english

File:

PDF, 553 KB

english, 1992

73

Theoretical study of the 2A22B2 separation of the alkali superoxides

Charles W. Bauschlicher Jr., Mariona Sodupe, Harry Partridge, Stephen R. Langhoff

Journal:

Chemical Physics Letters

Year:

1992

Language:

english

File:

PDF, 370 KB

english, 1992

74

Theoretical determination of the alkali-metal superoxide bond energies

Harry Partridge, Charles W. Bauschlicher Jr., Mariona Sodupe, Stephen R. Langhoff

Journal:

Chemical Physics Letters

Year:

1992

Language:

english

File:

PDF, 459 KB

english, 1992

75

The bonding in FeC5H+5

Mariona Sodupe, Charles W. Bauschlicher Jr.

Journal:

Chemical Physics Letters

Year:

1993

Language:

english

File:

PDF, 348 KB

english, 1993

76

The ground and low-lying excited states of MgH2+

Charles W. Bauschlicher Jr.

Journal:

Chemical Physics Letters

Year:

1993

Language:

english

File:

PDF, 343 KB

english, 1993

77

The bonding in the low-lying states of MgO+2

Mariona Sodupe, Charles W. Bauschlicher Jr.

Journal:

Chemical Physics Letters

Year:

1993

Language:

english

File:

PDF, 455 KB

english, 1993

78

A theoretical study of the spectroscopy of SrH2O+ and SrNH+3

Mariona Sodupe, Charles W. Bauschlicher Jr.

Journal:

Chemical Physics Letters

Year:

1993

Language:

english

File:

PDF, 576 KB

english, 1993

79

A study of the ground and low-lying states of MgCH+4

Charles W. Bauschlicher Jr., Mariona Sodupe

Journal:

Chemical Physics Letters

Year:

1993

Language:

english

File:

PDF, 549 KB

english, 1993

80

The vibrational frequencies of CH2OH

Charles W. Bauschlicher Jr., Harry Partridge

Journal:

Chemical Physics Letters

Year:

1993

Language:

english

File:

PDF, 344 KB

english, 1993

81

Theoretical study of the NO b 4Σ− and O+2 b 4Σ−g radiative lifetimes

Charles W. Bauschlicher Jr., Harry Partridge, Stephen R. Langhoff

Journal:

Chemical Physics Letters

Year:

1993

Language:

english

File:

PDF, 548 KB

english, 1993

82

A theoretical study of the electric dipole moment function of SiO

Stephen R. Langhoff, Charles W. Bauschlicher Jr.

Journal:

Chemical Physics Letters

Year:

1993

Language:

english

File:

PDF, 657 KB

english, 1993

83

Comment on “A MRCI PS and CASSCF study of the ground state MgO dissociation energy”

Charles W. Bauschlicher Jr., Harry Partridge

Journal:

Chemical Physics Letters

Year:

1993

Language:

english

File:

PDF, 491 KB

english, 1993

84

An accurate determination of the HO2 heat of formation

Charles W. Bauschlicher Jr., Harry Partridge

Journal:

Chemical Physics Letters

Year:

1993

Language:

english

File:

PDF, 482 KB

english, 1993

85

Ab initio potential energy surface for IHI−b. Simulation of IHI− photodetachment spectra

George C. Schatz, Scott Florance, Timothy J. Lee, Charles W. Bauschlicher Jr.

Journal:

Chemical Physics Letters

Year:

1993

Language:

english

File:

PDF, 570 KB

english, 1993

86

Theoretical study of the electronic states of MgC

Charles W. Bauschlicher Jr., Stephen R. Langhoff, Harry Partridge

Journal:

Chemical Physics Letters

Year:

1993

Language:

english

File:

PDF, 597 KB

english, 1993

87

Theoretical dipole moment for the X 2Π state of NO

Stephen R. Langhoff, Charles W. Bauschlicher Jr., Harry Partridge

Journal:

Chemical Physics Letters

Year:

1994

Language:

english

File:

PDF, 652 KB

english, 1994

88

Theoretical study of the nitric oxide ϵ and 11000 Å bands

Jeffrey A. Sheehy, Charles W. Bauschlicher Jr., Stephen R. Langhoff, Harry Partridge

Journal:

Chemical Physics Letters

Year:

1994

Language:

english

File:

PDF, 721 KB

english, 1994

89

The low-lying electronic states of Mg2+

Alessandra Ricca, Charles W. Bauschlicher Jr.

Journal:

Chemical Physics Letters

Year:

1994

Language:

english

File:

PDF, 318 KB

english, 1994

90

The molecular structure of cis-FONO

Timothy J. Lee, Charles W. Bauschlicher Jr., Christopher E. Dateo, Julia E. Rice

Journal:

Chemical Physics Letters

Year:

1994

Language:

english

File:

PDF, 405 KB

english, 1994

91

An ab initio study of HCuCO

Charles W. Bauschlicher Jr.

Journal:

Chemical Physics Letters

Year:

1994

Language:

english

File:

PDF, 358 KB

english, 1994

92

Cr2 revisited

Charles W. Bauschlicher Jr., Harry Partridge

Journal:

Chemical Physics Letters

Year:

1994

Language:

english

File:

PDF, 605 KB

english, 1994

93

Theoretical study of the low-lying states of MgN2+

Philippe Maitre, Charles W. Bauschlicher Jr.

Journal:

Chemical Physics Letters

Year:

1994

Language:

english

File:

PDF, 525 KB

english, 1994

94

On the interaction of CO and NH3 with BH3 and BF3

Charles W. Bauschlicher Jr., Alessandra Ricca

Journal:

Chemical Physics Letters

Year:

1995

Language:

english

File:

PDF, 452 KB

english, 1995

95

The bond dissociation energies of 1-butene

Charles W. Bauschlicher Jr.

Journal:

Chemical Physics Letters

Year:

1995

Language:

english

File:

PDF, 458 KB

english, 1995

96

The CH dissociation energy of C2H6

Charles W. Bauschlicher Jr., Harry Partridge

Journal:

Chemical Physics Letters

Year:

1995

Language:

english

File:

PDF, 429 KB

english, 1995

97

A study of the X 2Σ+ and A 2Π states of MgAr+ and MgKr+

Charles W. Bauschlicher Jr., Harry Partridge

Journal:

Chemical Physics Letters

Year:

1995

Language:

english

File:

PDF, 370 KB

english, 1995

98

What is the structure of FeC5H6+?

Charles W. Bauschlicher Jr., Mariona Sodupe

Journal:

Chemical Physics Letters

Year:

1995

Language:

english

File:

PDF, 659 KB

english, 1995

99

The low-lying electronic states of LiB

Alessandra Ricca, Charles W. Bauschlicher Jr.

Journal:

Chemical Physics Letters

Year:

1995

Language:

english

File:

PDF, 464 KB

english, 1995

100

The low-lying electronic states of LiC

Alessandra Ricca, Charles W. Bauschlicher Jr.

Journal:

Chemical Physics Letters

Year:

1995

Language:

english

File:

PDF, 448 KB

english, 1995

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