====== NBO ====== **NBO** is a software module available on **Comet**. ===== NBO overview ===== To access **NBO** on Comet, run ''module load NBO''. This will load the //default// version of **NBO**. An overview of the module information is shown below (''module -r spider ^NBO$''): NBO: NBO/7.0.0 Description: Natural Bond Orbital (NBO) 7 tools This module can be loaded directly: module load NBO/7.0.0 Help: NBO 7.0.0 This module sets up PATH and related variables for the NBO 7 suite. Key tools: - gennbo / gennbo.sh (wrappers) - binaries under nbo7/bin Example: module load NBO/7.0.0 gennbo input.gjf If there are multiple versions of **NBO** listed, then you can load a //specific// version as follows: $ module load NBO/version_string You can find the most //up to date information// whilst logged on to Comet by running ''module -r spider ^NBO$''. ---- ===== NBO Help ===== The module **NBO** has the following embedded help text (''module help NBO''): NBO 7.0.0 This module sets up PATH and related variables for the NBO 7 suite. Key tools: - gennbo / gennbo.sh (wrappers) - binaries under nbo7/bin Example: module load NBO/7.0.0 gennbo input.gjf ---- ===== NBO Dependencies ===== There are no dependencies listed for **NBO** ---- [[:advanced:software|Back to software]]