Parents (Total: 50)

The searched file hash is included in 50 parent files which include package known and seen by metalookup. A sample is included below:

Key	Value
FileSize	1324300
MD5	5334BDC67C5F0A27B2CDFBF7C71CD36B
PackageDescription	Computation Chemistry Integral Evaluation Library (development files) The Libint2 library is used to evaluate the traditional (electron repulsion) and certain novel two-body matrix elements (integrals) over Cartesian Gaussian functions used in modern atomic and molecular theory. The idea of the library is to let computer write optimized code for computing such integrals. There are two primary advantages to this: much less human effort is required to write code for computing new integrals, and code can be optimized specifically for a particular computer architecture (e.g., vector processor). . Libint2 has been utilized to implement methods such as Hartree-Fock (HF) and Kohn-Sham density functional theory (KS DFT), second-order Moeller-Plesset perturbation theory (MP2), coupled cluster singles and doubles (CCSD) method, as well as explicitly correlated R12 methods. . This package contains the static library and header files.
PackageMaintainer	Debichem Team <debichem-devel@lists.alioth.debian.org>
PackageName	libint2-dev
PackageSection	libdevel
PackageVersion	2.3.0~beta3-2
SHA-1	00A16CBAB921234882D6ED2F6AC11AB6F676CEAD
SHA-256	1EBFBB805060EEB7C5B00E9EBDB933A2EB98B7898F486809C1CD84C24E174A3D

Key	Value
FileSize	4012660
MD5	85C328843D167C11A1C031908D6B8AD8
PackageDescription	Computation Chemistry Integral Evaluation Library The LIBINT library is used to evaluate the traditional (electron repulsion) and certain novel two-body matrix elements (integrals) over Cartesian Gaussian functions used in modern atomic and molecular theory. The idea of the library is to let computer write optimized code for computing such integrals. There are two primary advantages to this: much less human effort is required to write code for computing new integrals, and code can be optimized specifically for a particular computer architecture (e.g., vector processor). . LIBINT has been utilized to implement methods such as Hartree-Fock (HF) and Kohn-Sham density functional theory (KS DFT), second-order Moeller-Plesset perturbation theory (MP2), coupled cluster singles and doubles (CCSD) method, as well as explicitly correlated R12 methods. . This package contains the shared library.
PackageMaintainer	Debichem Team <debichem-devel@lists.alioth.debian.org>
PackageName	libint2-2
PackageSection	libs
PackageVersion	2.6.0-13
SHA-1	08D8E95B8AF05B3A3FE715E56F6C8F59004A3167
SHA-256	91C3CFAD53DBE2E8D93C970B534C738E1A7199A027B80E06C658E5C21F7819A1

Key	Value
FileSize	1171990
MD5	13BF239067212445740D8F5CFDF35846
PackageDescription	Computation Chemistry Integral Evaluation Library The LIBINT library is used to evaluate the traditional (electron repulsion) and certain novel two-body matrix elements (integrals) over Cartesian Gaussian functions used in modern atomic and molecular theory. The idea of the library is to let computer write optimized code for computing such integrals. There are two primary advantages to this: much less human effort is required to write code for computing new integrals, and code can be optimized specifically for a particular computer architecture (e.g., vector processor). . LIBINT has been utilized to implement methods such as Hartree-Fock (HF) and Kohn-Sham density functional theory (KS DFT), second-order Moeller-Plesset perturbation theory (MP2), coupled cluster singles and doubles (CCSD) method, as well as explicitly correlated R12 methods. . This package contains the shared library.
PackageMaintainer	Debichem Team <debichem-devel@lists.alioth.debian.org>
PackageName	libint2-2
PackageSection	libs
PackageVersion	2.3.0~beta3-2
SHA-1	0AE12DD563DFA119566DE9B088159F280808898A
SHA-256	1734CAB755E064D3317879611F42E45CDE6F8442DDDCEF4F4CBE93BCB470FFEA

Key	Value
FileSize	20885376
MD5	7D4CB1B8C644CE8989D55A6418909B1D
PackageDescription	Computation Chemistry Integral Evaluation Library (development files) The Libint2 library is used to evaluate the traditional (electron repulsion) and certain novel two-body matrix elements (integrals) over Cartesian Gaussian functions used in modern atomic and molecular theory. The idea of the library is to let computer write optimized code for computing such integrals. There are two primary advantages to this: much less human effort is required to write code for computing new integrals, and code can be optimized specifically for a particular computer architecture (e.g., vector processor). . Libint2 has been utilized to implement methods such as Hartree-Fock (HF) and Kohn-Sham density functional theory (KS DFT), second-order Moeller-Plesset perturbation theory (MP2), coupled cluster singles and doubles (CCSD) method, as well as explicitly correlated R12 methods. . This package contains the static library and header files.
PackageMaintainer	Debichem Team <debichem-devel@lists.alioth.debian.org>
PackageName	libint2-dev
PackageSection	libdevel
PackageVersion	2.6.0-13
SHA-1	0DCFE23AFDDD5157CE30BCB1A3DEDE6350E0A9F1
SHA-256	C08EBA851574C495B9ACB443BBA83FDBE4D35E982667D35DD302BC678AE244EB

Key	Value
FileSize	1964556
MD5	2F3812D8CBA83DACB5C8FB0F2FD6040D
PackageDescription	Computation Chemistry Integral Evaluation Library The LIBINT library is used to evaluate the traditional (electron repulsion) and certain novel two-body matrix elements (integrals) over Cartesian Gaussian functions used in modern atomic and molecular theory. The idea of the library is to let computer write optimized code for computing such integrals. There are two primary advantages to this: much less human effort is required to write code for computing new integrals, and code can be optimized specifically for a particular computer architecture (e.g., vector processor). . LIBINT has been utilized to implement methods such as Hartree-Fock (HF) and Kohn-Sham density functional theory (KS DFT), second-order Moeller-Plesset perturbation theory (MP2), coupled cluster singles and doubles (CCSD) method, as well as explicitly correlated R12 methods. . This package contains the shared library.
PackageMaintainer	Debichem Team <debichem-devel@lists.alioth.debian.org>
PackageName	libint2-2
PackageSection	libs
PackageVersion	2.3.0~beta3-2
SHA-1	0DD1580CF981E6BA6504E80004C50E8A31B0A17C
SHA-256	92727261096A570C78E5D84952DD2983440B00BACC1A85ED8639B89CECCB2F40

Key	Value
FileSize	1693274
MD5	A20B6FFF5AF61CD9F64EA49A4E9D5D5F
PackageDescription	Computation Chemistry Integral Evaluation Library The LIBINT library is used to evaluate the traditional (electron repulsion) and certain novel two-body matrix elements (integrals) over Cartesian Gaussian functions used in modern atomic and molecular theory. The idea of the library is to let computer write optimized code for computing such integrals. There are two primary advantages to this: much less human effort is required to write code for computing new integrals, and code can be optimized specifically for a particular computer architecture (e.g., vector processor). . LIBINT has been utilized to implement methods such as Hartree-Fock (HF) and Kohn-Sham density functional theory (KS DFT), second-order Moeller-Plesset perturbation theory (MP2), coupled cluster singles and doubles (CCSD) method, as well as explicitly correlated R12 methods. . This package contains the shared library.
PackageMaintainer	Debichem Team <debichem-devel@lists.alioth.debian.org>
PackageName	libint2-2
PackageSection	libs
PackageVersion	2.3.0~beta3-2
SHA-1	0FC5D5997E2B6C2859FE4196C0980DD7C2AD675E
SHA-256	FD5F8F819A73CDA7DBB69A5CF07F3B490C36C67BAA32377FBECEFE3D9F1D1671

Key	Value
FileSize	21377100
MD5	77151D864FAE7D86D576BE1FF97D2B68
PackageDescription	Computation Chemistry Integral Evaluation Library (development files) The Libint2 library is used to evaluate the traditional (electron repulsion) and certain novel two-body matrix elements (integrals) over Cartesian Gaussian functions used in modern atomic and molecular theory. The idea of the library is to let computer write optimized code for computing such integrals. There are two primary advantages to this: much less human effort is required to write code for computing new integrals, and code can be optimized specifically for a particular computer architecture (e.g., vector processor). . Libint2 has been utilized to implement methods such as Hartree-Fock (HF) and Kohn-Sham density functional theory (KS DFT), second-order Moeller-Plesset perturbation theory (MP2), coupled cluster singles and doubles (CCSD) method, as well as explicitly correlated R12 methods. . This package contains the static library and header files.
PackageMaintainer	Debichem Team <debichem-devel@lists.alioth.debian.org>
PackageName	libint2-dev
PackageSection	libdevel
PackageVersion	2.6.0-13
SHA-1	1262CA2511C28BF66D8ED3251AA5D4A2BCB1F883
SHA-256	EF470D6221E52F1F3C3CC1891014520BF7087FFC9B454CF68E1247BAA53FDEFA

Key	Value
FileSize	1515492
MD5	351EB9148A7F01672DB8D4567CDA3E76
PackageDescription	Computation Chemistry Integral Evaluation Library (development files) The Libint2 library is used to evaluate the traditional (electron repulsion) and certain novel two-body matrix elements (integrals) over Cartesian Gaussian functions used in modern atomic and molecular theory. The idea of the library is to let computer write optimized code for computing such integrals. There are two primary advantages to this: much less human effort is required to write code for computing new integrals, and code can be optimized specifically for a particular computer architecture (e.g., vector processor). . Libint2 has been utilized to implement methods such as Hartree-Fock (HF) and Kohn-Sham density functional theory (KS DFT), second-order Moeller-Plesset perturbation theory (MP2), coupled cluster singles and doubles (CCSD) method, as well as explicitly correlated R12 methods. . This package contains the static library and header files.
PackageMaintainer	Debichem Team <debichem-devel@lists.alioth.debian.org>
PackageName	libint2-dev
PackageSection	libdevel
PackageVersion	2.3.0~beta3-2
SHA-1	26169F0C04417D156662184166358AD07D04CB74
SHA-256	379B81FA17B7B538BBC0FF664C0BA245F2A85D156FFD42AD1E981310CF9C1741

Key	Value
FileSize	3906472
MD5	B5AF82B07629F12FA42A72CF440D7A80
PackageDescription	Computation Chemistry Integral Evaluation Library The LIBINT library is used to evaluate the traditional (electron repulsion) and certain novel two-body matrix elements (integrals) over Cartesian Gaussian functions used in modern atomic and molecular theory. The idea of the library is to let computer write optimized code for computing such integrals. There are two primary advantages to this: much less human effort is required to write code for computing new integrals, and code can be optimized specifically for a particular computer architecture (e.g., vector processor). . LIBINT has been utilized to implement methods such as Hartree-Fock (HF) and Kohn-Sham density functional theory (KS DFT), second-order Moeller-Plesset perturbation theory (MP2), coupled cluster singles and doubles (CCSD) method, as well as explicitly correlated R12 methods. . This package contains the shared library.
PackageMaintainer	Debichem Team <debichem-devel@lists.alioth.debian.org>
PackageName	libint2-2
PackageSection	libs
PackageVersion	2.6.0-13
SHA-1	263963BA0892DC9035C0F1A8AC6BA355C9186F80
SHA-256	B3E7BF352E041C7C76C78E7A040CCF0867D0E3E15AA0B738D4572151490172CB

Key	Value
FileSize	874654
MD5	AFFB23A661A7D7F025F0447A82A78DD9
PackageDescription	Computation Chemistry Integral Evaluation Library The LIBINT library is used to evaluate the traditional (electron repulsion) and certain novel two-body matrix elements (integrals) over Cartesian Gaussian functions used in modern atomic and molecular theory. The idea of the library is to let computer write optimized code for computing such integrals. There are two primary advantages to this: much less human effort is required to write code for computing new integrals, and code can be optimized specifically for a particular computer architecture (e.g., vector processor). . LIBINT has been utilized to implement methods such as Hartree-Fock (HF) and Kohn-Sham density functional theory (KS DFT), second-order Moeller-Plesset perturbation theory (MP2), coupled cluster singles and doubles (CCSD) method, as well as explicitly correlated R12 methods. . This package contains the shared library.
PackageMaintainer	Ubuntu Developers <ubuntu-devel-discuss@lists.ubuntu.com>
PackageName	libint2-2
PackageSection	libs
PackageVersion	2.3.0~beta3-2
SHA-1	31755EE9EE84C8316EBC68A18575C518879D4660
SHA-256	062B1E398FA6D00AFC27D8E1B2267D79019DF0A1CDE55C786C382ADC3A791E6F